A0A087YQE5_POEFO Loading...

Chromosome 6 open reading frame 120

AlphaFold DB , UniProt , Accession A0A087YQE5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 180 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	46.8	Very low	248 Å²	248	142.4 Å²	142.4	100%	1.222	84%	0.838	S	S	*	*				0	116.9	0	-71.2	160.2	87.7	0	0	106.9
2	M	39.5	Very low	47	Very low	182 Å²	182	143 Å²	143	90%	0.897	83%	0.834	S	S	*	*			trans	-73.7	138.2	-173.5	-72.9	-84.5	164.7	0	0	110.7
3	L	44.9	Very low	47.8	Very low	167 Å²	167	146.8 Å²	146.8	87%	0.874	84%	0.835	S	S	*	*			trans	-160.1	83.2	144.1	-131.8	72.1	0	0	0	109.3
4	G	43.4	Very low	48.4	Very low	71 Å²	71	146.7 Å²	146.7	73%	0.732	83%	0.829	S	S	*	*			trans	-73.1	135.3	171.9	0	0	0	0	0	110.6	A6	G4-A6 PolarHBondContact O-N 3.36Å
5	H	47.4	Very low	48.8	Very low	191 Å²	191	145.1 Å²	145.1	88%	0.884	83%	0.827	S	S	*	*			trans	-71.5	115.7	177.3	-72.1	48.4	0	0	0	109.7	A7	H5-A7 PolarHBondContact O-N 3.39Å
6	A	48.7	Very low	49.2	Very low	104 Å²	104	147.9 Å²	147.9	86%	0.86	83%	0.831	S	S	*	*			trans	-88.9	97.1	171.3	0	0	0	0	0	109.2	G4	G4-A6 PolarHBondContact O-N 3.36Å
7	A	52.4	Low	49.7	Very low	91 Å²	91	144.5 Å²	144.5	75%	0.752	83%	0.826	S	S	*	*			trans	-82	110.7	164.7	0	0	0	0	0	108.4	H5 L9	H5-A7 PolarHBondContact O-N 3.39Å; A7-L9 PolarHBondContact O-N 3.23Å
8	L	46.2	Very low	49.8	Very low	163 Å²	163	139.9 Å²	139.9	85%	0.853	82%	0.815	S	S	*	*			trans	-78.4	99.4	176.2	-169.1	79.4	0	0	0	109	V10	L8-V10 HydrophobicContact CD2-CG2 4.17Å; L8-V10 HydrophobicContact CG-CG2 4.26Å
9	L	47.2	Very low	49.9	Very low	165 Å²	165	138.1 Å²	138.1	86%	0.864	81%	0.811	S	S	*	*			trans	-89.4	101.7	168.9	-87.5	159.3	0	0	0	108.9	A7 A11	A7-L9 PolarHBondContact O-N 3.23Å; L9-A11 PolarHBondContact O-N 3.19Å
10	V	49.4	Very low	49.7	Very low	108 Å²	108	140.9 Å²	140.9	66%	0.655	81%	0.813	S	S	*	*			trans	-79.7	103	168	177.7	0	0	0	0	107.6	L8 L12	L8-V10 HydrophobicContact CD2-CG2 4.17Å; L8-V10 HydrophobicContact CG-CG2 4.26Å; V10-L12 PolarHBondContact O-N 2.82Å
11	A	55.8	Low	49.7	Very low	76 Å²	76	141.6 Å²	141.6	63%	0.628	81%	0.813	S	S	*	*			trans	-78	103.7	170	0	0	0	0	0	109.1	L9 F13	L9-A11 PolarHBondContact O-N 3.19Å; A11-F13 HydrophobicContact CB-CE2 4.4Å; A11-F13 PolarHBondContact O-N 3.07Å
12	L	50.1	Low	50.2	Low	150 Å²	150	133.7 Å²	133.7	79%	0.785	78%	0.783	S	S	*	*			trans	-73.3	102.3	167.7	-80.7	159.6	0	0	0	108.5	V10 L14	V10-L12 PolarHBondContact O-N 2.82Å; L12-L14 PolarHBondContact O-N 2.99Å
13	F	56.7	Low	50.4	Low	193 Å²	193	130.3 Å²	130.3	85%	0.846	77%	0.774	S	S	*	*			trans	-73.9	101.9	164.1	-79.1	-87.8	0	0	0	108.2	A11	A11-F13 HydrophobicContact CB-CE2 4.4Å; A11-F13 PolarHBondContact O-N 3.07Å
14	L	56.5	Low	50.8	Low	145 Å²	145	127 Å²	127	76%	0.759	77%	0.77	S	S	*	*			trans	-71.3	126.9	160.9	-79.3	99.1	0	0	0	108	L12 Q16	L12-L14 PolarHBondContact O-N 2.99Å; L14-Q16 PolarHBondContact O-N 3.06Å; L14-Q16 VanDerWaalsContact O-N 3.16Å
15	P	54	Low	51.2	Low	122 Å²	122	131.4 Å²	131.4	79%	0.792	77%	0.772	S	S	*	*			trans	-67	115.6	165	27.1	-29	0	0	0	107.2	A17	P15-A17 VanDerWaalsContact C-N 3.27Å; P15-A17 PolarHBondContact O-N 2.87Å
16	Q	55.9	Low	52	Low	191 Å²	191	129.5 Å²	129.5	89%	0.893	77%	0.769	S	S	*	*			trans	-67.3	98.1	162	-67.2	-155.2	-24.3	0	0	106.4	L14 G18	L14-Q16 PolarHBondContact O-N 3.06Å; L14-Q16 VanDerWaalsContact O-N 3.16Å; Q16-G18 PolarHBondContact O-N 2.59Å
17	A	58	Low	53.1	Low	90 Å²	90	128.2 Å²	128.2	74%	0.744	75%	0.747	S	S	*	*			trans	-64.1	85.8	159.3	0	0	0	0	0	106.2	P15 S19	P15-A17 VanDerWaalsContact C-N 3.27Å; P15-A17 PolarHBondContact O-N 2.87Å; A17-S19 VanDerWaalsContact C-N 3.29Å; A17-S19 PolarHBondContact O-N 3.34Å
18	G	50.5	Low	54.4	Low	62 Å²	62	126.6 Å²	126.6	64%	0.639	74%	0.74	S	S	*	*			trans	-63.3	99.7	162.5	0	0	0	0	0	106.1	Q16 F20	Q16-G18 PolarHBondContact O-N 2.59Å; G18-F20 VanDerWaalsContact C-N 3.31Å; G18-F20 PolarHBondContact O-N 3.01Å
19	S	51.9	Low	56.4	Low	105 Å²	105	120.9 Å²	120.9	73%	0.734	71%	0.709	S	S	*	*			trans	-54.2	102.5	164.4	-59.5	0	0	0	0	106.9	A17 L21	A17-S19 VanDerWaalsContact C-N 3.29Å; A17-S19 PolarHBondContact O-N 3.34Å; S19-L21 PolarHBondContact O-N 3.27Å
20	F	46.5	Very low	58.4	Low	194 Å²	194	114.9 Å²	114.9	85%	0.851	68%	0.681	S	S	*	*			trans	-70.6	72.5	166.6	-125.8	-92.9	0	0	0	106.3	G18 S22	G18-F20 VanDerWaalsContact C-N 3.31Å; G18-F20 PolarHBondContact O-N 3.01Å; F20-S22 PolarHBondContact O-N 3.22Å; F20-S22 VanDerWaalsContact O-N 3.08Å
21	L	48.8	Very low	60.3	Low	156 Å²	156	119 Å²	119	82%	0.817	69%	0.693	S	S	*	*			trans	-73.9	88.6	155.6	-73.1	169.4	0	0	0	104.1	S19	S19-L21 PolarHBondContact O-N 3.27Å
22	S	51.3	Low	62.1	Low	82 Å²	82	119.4 Å²	119.4	57%	0.573	68%	0.681	S	S	*	*			trans	-50.4	128.3	157.3	-61	0	0	0	0	106	F20 A24	F20-S22 PolarHBondContact O-N 3.22Å; F20-S22 VanDerWaalsContact O-N 3.08Å; S22-A24 PolarHBondContact O-N 3.32Å
23	P	43.8	Very low	64.2	Low	110 Å²	110	114.5 Å²	114.5	71%	0.714	65%	0.653	S	S	*	*			trans	-52.8	131.1	166.5	24.2	-30	0	0	0	105.8	E25	P23-E25 PolarHBondContact O-N 3.29Å
24	A	52.4	Low	66.1	Low	97 Å²	97	108 Å²	108	80%	0.802	63%	0.628	S	S	*	*			trans	-49.1	112	168	0	0	0	0	0	105.3	S22 D26	S22-A24 PolarHBondContact O-N 3.32Å; A24-D26 PolarHBondContact O-N 3.07Å
25	E	52.7	Low	68	Low	164 Å²	164	105.2 Å²	105.2	77%	0.766	61%	0.614	S	S	*	*			trans	-54.5	120.6	171.7	-65.7	-176.9	127.1	0	0	103.9	P23 D27	P23-E25 PolarHBondContact O-N 3.29Å; E25-D27 PolarHBondContact O-N 2.97Å
26	D	62.2	Low	70	Confident	152 Å²	152	102 Å²	102	81%	0.813	59%	0.59	S	S	*	*			trans	-64.8	89.3	171.9	177.9	20.5	0	0	0	105	A24 G28	A24-D26 PolarHBondContact O-N 3.07Å; D26-G28 PolarHBondContact O-N 3.2Å
27	D	71.8	Confident	71.9	Confident	76 Å²	76	97.4 Å²	97.4	41%	0.406	57%	0.568	S	S	.	*			trans	-61.5	2.8	-176.2	-81.2	-9.2	0	0	0	111.9	E25 I29 R126	E25-D27 PolarHBondContact O-N 2.97Å; D27-I29 HydrophobicContact CB-CG1 3.79Å; D27-I29 PolarHBondContact O-N 3.41Å; D27-R126 IonicContact OD2-CZ 3.9Å; D27-R126 IonicContact OD2-NH1 3.89Å; D27-R126 PolarHBondContact OD2-NH1 3.13Å; D27-R126 IonicContact OD2-NH2 2.76Å; D27-R126 PolarHBondContact OD2-NH2 2.74Å
28	G	81.3	Confident	73.8	Confident	58 Å²	58	96.7 Å²	96.7	60%	0.598	55%	0.554	S	S	*	*			trans	66.8	19	-177.8	0	0	0	0	0	112.4	D26 P30	D26-G28 PolarHBondContact O-N 3.2Å; G28-P30 WeakPolarHBondContact O-CD 3.09Å
29	I	87.1	Confident	76	Confident	42 Å²	42	96 Å²	96	22%	0.215	54%	0.538	C	S	.	.			trans	-77.8	121.5	178.9	-59.1	-61.8	0	0	0	108.6	D27 W33 F128	D27-I29 HydrophobicContact CB-CG1 3.79Å; D27-I29 PolarHBondContact O-N 3.41Å; I29-W33 HydrophobicContact CD1-CE3 4.34Å; I29-W33 HydrophobicContact CD1-CZ3 4.18Å; I29-W33 HydrophobicContact CG2-CB 4.12Å; I29-W33 HydrophobicContact CG2-CE3 3.95Å; I29-F128 HydrophobicContact CD1-CE2 4.3Å; I29-F128 HydrophobicContact CD1-CZ 4.2Å; I29-F128 HydrophobicContact CG1-CZ 4.38Å; I29-F128 HydrophobicContact CG2-CD1 4.4Å; I29-F128 HydrophobicContact CG2-CE1 3.9Å; I29-F128 HydrophobicContact CG2-CZ 4.12Å
30	P	90.5	Very high	78.2	Confident	40 Å²	40	97.2 Å²	97.2	26%	0.26	53%	0.532	S	S	.	.			trans	-60.1	143.9	177.9	-21.7	32.6	0	0	0	112.6	G28 E32 W33	G28-P30 WeakPolarHBondContact O-CD 3.09Å; P30-E32 HydrophobicContact CB-CG 3.88Å; P30-E32 WeakPolarHBondContact CB-OE1 3.41Å; P30-E32 WeakPolarHBondContact CB-OE2 3.5Å; P30-E32 PolarHBondContact O-N 3.24Å; P30-W33 HydrophobicContact CB-CG 4.41Å; P30-W33 HydrophobicContact CG-CD2 4.1Å; P30-W33 HydrophobicContact CG-CG 4.49Å; P30-W33 HydrophobicContact CG-CH2 4.4Å; P30-W33 HydrophobicContact CG-CZ2 4Å; P30-W33 WeakPolarHBondContact O-CB 3.3Å; P30-W33 PolarHBondContact O-N 3.01Å
31	E	89.2	Confident	80.6	Confident	194 Å²	194	88.8 Å²	88.8	91%	0.907	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-25.4	-179.1	-67.1	-172.7	173.2	0	0	112.7	W33	E31-W33 PolarHBondContact O-N 2.83Å
32	E	92.7	Very high	83	Confident	84 Å²	84	86.5 Å²	86.5	39%	0.393	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-11.7	175.8	60.9	-97.4	-141.6	0	0	114.2	P30 Q131 A132	P30-E32 HydrophobicContact CB-CG 3.88Å; P30-E32 WeakPolarHBondContact CB-OE1 3.41Å; P30-E32 WeakPolarHBondContact CB-OE2 3.5Å; P30-E32 PolarHBondContact O-N 3.24Å; E32-Q131 WeakPolarHBondContact O-CB 3.35Å; E32-Q131 PolarHBondContact O-N 2.78Å; E32-A132 HydrophobicContact CB-CB 3.93Å; E32-A132 HydrophobicContact CG-CB 3.87Å
33	W	94.8	Very high	85.2	Confident	48 Å²	48	83 Å²	83	18%	0.182	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	115.6	179.4	-71.7	8.8	0	0	0	111	I29 P30 E31 I60 F128 Y129	I29-W33 HydrophobicContact CD1-CE3 4.34Å; I29-W33 HydrophobicContact CD1-CZ3 4.18Å; I29-W33 HydrophobicContact CG2-CB 4.12Å; I29-W33 HydrophobicContact CG2-CE3 3.95Å; P30-W33 HydrophobicContact CB-CG 4.41Å; P30-W33 HydrophobicContact CG-CD2 4.1Å; P30-W33 HydrophobicContact CG-CG 4.49Å; P30-W33 HydrophobicContact CG-CH2 4.4Å; P30-W33 HydrophobicContact CG-CZ2 4Å; P30-W33 WeakPolarHBondContact O-CB 3.3Å; P30-W33 PolarHBondContact O-N 3.01Å; E31-W33 PolarHBondContact O-N 2.83Å; W33-I60 HydrophobicContact CD2-CB 4.46Å; W33-I60 HydrophobicContact CD2-CD1 3.86Å; W33-I60 HydrophobicContact CD2-CG1 4.04Å; W33-I60 HydrophobicContact CE3-CB 4.28Å; W33-I60 HydrophobicContact CE3-CG1 4.31Å; W33-I60 HydrophobicContact CE3-CG2 4.18Å; W33-I60 HydrophobicContact CG-CD1 4.06Å; W33-I60 HydrophobicContact CH2-CB 4.39Å; W33-I60 HydrophobicContact CH2-CG1 4.08Å; W33-I60 HydrophobicContact CH2-CG2 3.76Å; W33-I60 HydrophobicContact CZ2-CD1 4.2Å; W33-I60 HydrophobicContact CZ2-CG1 3.73Å; W33-I60 HydrophobicContact CZ2-CG2 4.29Å; W33-I60 HydrophobicContact CZ3-CB 4.26Å; W33-I60 HydrophobicContact CZ3-CG1 4.34Å; W33-I60 HydrophobicContact CZ3-CG2 3.68Å; W33-F128 HydrophobicContact CB-CB 3.95Å; W33-F128 HydrophobicContact CB-CD1 3.94Å; W33-F128 HydrophobicContact CB-CG 4.15Å; W33-F128 HydrophobicContact CD2-CB 4.48Å; W33-F128 HydrophobicContact CE3-CB 4.35Å; W33-F128 HydrophobicContact CE3-CD2 4.16Å; W33-F128 HydrophobicContact CE3-CG 4.17Å; W33-F128 HydrophobicContact CG-CB 4.32Å; W33-Y129 WeakPolarHBondContact CA-O 3.32Å
34	V	95.6	Very high	87.8	Confident	56 Å²	56	79.1 Å²	79.1	34%	0.339	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	118	175.9	176.1	0	0	0	0	110	L36 F128 Y129 Q131	V34-L36 PolarHBondContact O-N 2.91Å; V34-F128 CarbonylContact O-C 3.57Å; V34-F128 VanDerWaalsContact O-CA 3.28Å; V34-F128 WeakPolarHBondContact O-CA 3.42Å; V34-Y129 PolarHBondContact N-O 3.45Å; V34-Y129 PolarHBondContact O-N 3.22Å; V34-Q131 HydrophobicContact CG2-CG 4Å
35	L	96.7	Very high	89.9	Confident	86 Å²	86	76.9 Å²	76.9	45%	0.45	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	119.5	174.8	-177.5	65.2	0	0	0	110	V38 R126 F128	L35-V38 HydrophobicContact CD1-CG2 4.08Å; L35-V38 HydrophobicContact CD2-CG2 3.94Å; L35-V38 HydrophobicContact CG-CG2 4.41Å; L35-R126 HydrophobicContact CD1-CB 3.92Å; L35-R126 HydrophobicContact CD1-CG 4.43Å; L35-F128 HydrophobicContact CB-CD1 3.91Å; L35-F128 HydrophobicContact CB-CE1 3.78Å; L35-F128 HydrophobicContact CD1-CD1 4.08Å; L35-F128 HydrophobicContact CD1-CE1 3.74Å; L35-F128 HydrophobicContact CD1-CE2 4.39Å; L35-F128 HydrophobicContact CD1-CZ 3.92Å; L35-F128 HydrophobicContact CG-CE1 4.32Å
36	L	96.3	Very high	92.1	Very high	55 Å²	55	70.9 Å²	70.9	29%	0.288	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-51	176	-60.3	-177	0	0	0	111.5	V34 H55 I59 V127	V34-L36 PolarHBondContact O-N 2.91Å; L36-H55 HydrophobicContact CD1-CB 4.36Å; L36-I59 HydrophobicContact CD1-CD1 3.95Å; L36-V127 WeakPolarHBondContact CB-O 3.33Å; L36-V127 PolarHBondContact N-O 3.27Å
37	H	96	Very high	93.8	Very high	95 Å²	95	68.2 Å²	68.2	44%	0.44	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	151.3	-172.3	-63.8	-74.6	0	0	0	111.2	H55 V127	H37-H55 AromaticContact CD2-NE2 3.83Å; H37-H55 AromaticContact NE2-NE2 3.34Å; H37-H55 PolarHBondContact NE2-NE2 2.83Å; H37-V127 HydrophobicContact CB-CB 4.21Å; H37-V127 HydrophobicContact CB-CG2 4.34Å; H37-V127 PolarHBondContact N-O 3.45Å; H37-V127 PolarHBondContact O-N 3Å
38	V	97.6	Very high	95.1	Very high	74 Å²	74	66.2 Å²	66.2	45%	0.448	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	128.3	166.2	-174.4	0	0	0	0	107.6	L35 E124 I125 R126	L35-V38 HydrophobicContact CD1-CG2 4.08Å; L35-V38 HydrophobicContact CD2-CG2 3.94Å; L35-V38 HydrophobicContact CG-CG2 4.41Å; V38-E124 HydrophobicContact CG1-CG 3.59Å; V38-I125 CarbonylContact C-O 3.57Å; V38-I125 WeakPolarHBondContact CA-O 3.43Å; V38-R126 HydrophobicContact CG1-CG 4.32Å; V38-R126 HydrophobicContact CG2-CG 4.23Å
39	V	97.4	Very high	95.8	Very high	48 Å²	48	65.3 Å²	65.3	29%	0.291	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	125	179.9	-177.6	0	0	0	0	108.3	L51 E124 I125	V39-L51 HydrophobicContact CG1-CD1 4.02Å; V39-L51 HydrophobicContact CG1-CD2 4.35Å; V39-E124 CarbonylContact O-C 3.49Å; V39-E124 WeakPolarHBondContact O-CA 3.39Å; V39-I125 HydrophobicContact CB-CB 4.48Å; V39-I125 PolarHBondContact N-O 3.39Å; V39-I125 PolarHBondContact O-N 2.94Å
40	Q	97.8	Very high	96.4	Very high	131 Å²	131	67.9 Å²	67.9	61%	0.612	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.4	151.4	174.9	-68.6	178.9	-26.4	0	0	110.1	F123 E124	Q40-F123 WeakPolarHBondContact CA-O 3.41Å; Q40-E124 HydrophobicContact CG-CB 4.05Å; Q40-E124 HydrophobicContact CG-CG 3.91Å; Q40-E124 PolarHBondContact NE2-OE2 2.85Å
41	G	97	Very high	96.7	Very high	16 Å²	16	68.5 Å²	68.5	17%	0.165	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.1	171.9	178.8	0	0	0	0	0	114.6	E122 F123	G41-E122 WeakPolarHBondContact O-CA 3.3Å; G41-F123 PolarHBondContact N-O 2.83Å; G41-F123 WeakPolarHBondContact O-CD1 3.33Å; G41-F123 PolarHBondContact O-N 2.77Å
42	H	97.8	Very high	97.2	Very high	108 Å²	108	67 Å²	67	50%	0.5	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	138.4	179.3	-59.8	66.1	0	0	0	107.9	S121 E122	H42-S121 CarbonylContact C-O 3.55Å; H42-S121 WeakPolarHBondContact CA-O 3.34Å; H42-E122 WeakPolarHBondContact CD2-CG 3.28Å; H42-E122 IonicContact CD2-OE1 3.57Å; H42-E122 IonicContact CD2-OE2 3.04Å; H42-E122 IonicContact CE1-OE2 3.92Å; H42-E122 WeakPolarHBondContact NE2-CG 3.48Å; H42-E122 IonicContact NE2-OE1 3.27Å; H42-E122 IonicContact NE2-OE2 2.92Å; H42-E122 PolarHBondContact NE2-OE2 2.96Å
43	I	98	Very high	97.4	Very high	9 Å²	9	63.6 Å²	63.6	5%	0.046	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	134.1	179	-169.7	56.8	0	0	0	111.3	N47 E120 S121 F123	I43-N47 HydrophobicContact CD1-CB 3.8Å; I43-N47 HydrophobicContact CG1-CB 4.34Å; I43-N47 WeakPolarHBondContact CG1-O 3.41Å; I43-E120 CarbonylContact O-C 3.57Å; I43-E120 WeakPolarHBondContact O-CA 3.28Å; I43-S121 PolarHBondContact N-O 2.83Å; I43-S121 PolarHBondContact O-N 2.99Å; I43-F123 HydrophobicContact CB-CE1 4.4Å; I43-F123 HydrophobicContact CG2-CD1 4.31Å; I43-F123 HydrophobicContact CG2-CE1 4.22Å
44	G	98.4	Very high	97.5	Very high	29 Å²	29	66.5 Å²	66.5	30%	0.299	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	158.4	177.5	0	0	0	0	0	112.9	G46 N47	G44-G46 PolarHBondContact O-N 3.12Å; G44-N47 WeakPolarHBondContact O-CB 3.19Å; G44-N47 PolarHBondContact O-N 3.04Å; G44-N47 VanDerWaalsContact O-N 3.08Å
45	A	98.1	Very high	97.4	Very high	49 Å²	49	67.8 Å²	67.8	41%	0.405	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.4	124.8	174.7	0	0	0	0	0	112.4	N47 Y118 Q119	A45-N47 PolarHBondContact O-N 3.06Å; A45-Y118 WeakPolarHBondContact CB-O 3.39Å; A45-Q119 PolarHBondContact N-O 2.75Å
46	G	97.4	Very high	97.3	Very high	39 Å²	39	69 Å²	69	40%	0.402	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	8.5	175.8	0	0	0	0	0	115.3	G44 Y113 G114	G44-G46 PolarHBondContact O-N 3.12Å; G46-Y113 VanDerWaalsContact C-CE2 3.45Å; G46-G114 PolarHBondContact N-O 3.01Å
47	N	98.4	Very high	97.1	Very high	96 Å²	96	66.5 Å²	66.5	51%	0.513	36%	0.355	S	S	.	.			trans	-109.3	167.2	-178.2	-158.6	5.4	0	0	0	112.1	I43 G44 A45 Y113 G114	I43-N47 HydrophobicContact CD1-CB 3.8Å; I43-N47 HydrophobicContact CG1-CB 4.34Å; I43-N47 WeakPolarHBondContact CG1-O 3.41Å; G44-N47 WeakPolarHBondContact O-CB 3.19Å; G44-N47 PolarHBondContact O-N 3.04Å; G44-N47 VanDerWaalsContact O-N 3.08Å; A45-N47 PolarHBondContact O-N 3.06Å; N47-Y113 WeakPolarHBondContact O-CA 3.43Å; N47-Y113 WeakPolarHBondContact O-CD2 3.06Å; N47-G114 PolarHBondContact O-N 3.14Å
48	Y	98.2	Very high	97.2	Very high	33 Å²	33	65.9 Å²	65.9	13%	0.129	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	141.1	-179.8	-75.2	-91.7	0	0	0	113.2	Y50 Y73 N82 F83 V112 Y113	Y48-Y50 WeakPolarHBondContact CB-OH 3.41Å; Y48-Y50 HydrophobicContact CD1-CE1 4.14Å; Y48-Y50 HydrophobicContact CG-CE1 4.29Å; Y48-Y50 HydrophobicContact CG-CE2 4.48Å; Y48-Y50 AromaticContact CG-CZ 3.84Å; Y48-Y73 HydrophobicContact CE1-CD2 4.19Å; Y48-N82 HydrophobicContact CE1-CB 4Å; Y48-N82 HydrophobicContact CE2-CB 4.14Å; Y48-F83 WeakPolarHBondContact OH-CD1 3.34Å; Y48-F83 PolarHBondContact OH-N 3.22Å; Y48-V112 CarbonylContact C-O 3.54Å; Y48-V112 VanDerWaalsContact CA-O 3.3Å; Y48-V112 WeakPolarHBondContact CA-O 3.36Å; Y48-Y113 HydrophobicContact CD1-CD2 4.21Å; Y48-Y113 AromaticContact CD2-CD2 3.8Å; Y48-Y113 HydrophobicContact CD2-CD2 3.8Å; Y48-Y113 HydrophobicContact CD2-CE2 4.34Å; Y48-Y113 AromaticContact CE1-CD2 3.78Å; Y48-Y113 HydrophobicContact CE1-CD2 3.78Å; Y48-Y113 AromaticContact CE1-CG 3.98Å; Y48-Y113 HydrophobicContact CE1-CG 3.98Å; Y48-Y113 AromaticContact CE2-CD2 3.3Å; Y48-Y113 HydrophobicContact CE2-CD2 3.3Å; Y48-Y113 AromaticContact CE2-CE2 3.7Å; Y48-Y113 HydrophobicContact CE2-CE2 3.7Å; Y48-Y113 HydrophobicContact CE2-CG 4.26Å; Y48-Y113 HydrophobicContact CG-CD2 4.22Å; Y48-Y113 AromaticContact CZ-CD2 3.27Å; Y48-Y113 AromaticContact CZ-CE2 3.96Å; Y48-Y113 AromaticContact CZ-CG 3.77Å
49	S	97.8	Very high	97.2	Very high	40 Å²	40	62.3 Å²	62.3	28%	0.28	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	138	160	-79.1	0	0	0	0	109.4	V112	S49-V112 PolarHBondContact N-O 2.88Å; S49-V112 PolarHBondContact O-N 2.82Å
50	Y	98.3	Very high	97.2	Very high	95 Å²	95	60 Å²	60	37%	0.373	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130.4	-176.1	-61.4	-74.6	0	0	0	112.2	Y48 H80 P81 I110	Y48-Y50 WeakPolarHBondContact CB-OH 3.41Å; Y48-Y50 HydrophobicContact CD1-CE1 4.14Å; Y48-Y50 HydrophobicContact CG-CE1 4.29Å; Y48-Y50 HydrophobicContact CG-CE2 4.48Å; Y48-Y50 AromaticContact CG-CZ 3.84Å; Y50-H80 HydrophobicContact CD1-CB 4.14Å; Y50-H80 AromaticContact CD2-CD2 3.66Å; Y50-H80 VanDerWaalsContact CE1-CA 3.45Å; Y50-H80 HydrophobicContact CE1-CB 3.78Å; Y50-H80 HydrophobicContact CE2-CB 4.49Å; Y50-H80 AromaticContact CE2-CD2 3.9Å; Y50-H80 AromaticContact CG-CD2 3.75Å; Y50-P81 WeakPolarHBondContact CE1-O 3.15Å; Y50-I110 CarbonylContact C-O 3.52Å; Y50-I110 VanDerWaalsContact CA-O 3.3Å; Y50-I110 WeakPolarHBondContact CA-O 3.4Å
51	L	98	Very high	97.2	Very high	54 Å²	54	53.9 Å²	53.9	28%	0.283	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	158.3	177.2	-54.7	172.4	0	0	0	110.1	V39 I110 I125	V39-L51 HydrophobicContact CG1-CD1 4.02Å; V39-L51 HydrophobicContact CG1-CD2 4.35Å; L51-I110 HydrophobicContact CB-CB 4.15Å; L51-I110 PolarHBondContact N-O 3.08Å; L51-I110 PolarHBondContact O-N 3.17Å; L51-I125 HydrophobicContact CD1-CD1 3.91Å
52	R	98.1	Very high	97.2	Very high	163 Å²	163	53.9 Å²	53.9	62%	0.615	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	127.7	177.5	-60	-177.5	-174.7	-178.4	-1	109.8	L79 P107 V108	R52-L79 HydrophobicContact CG-CD2 4.39Å; R52-P107 HydrophobicContact CB-CB 4.5Å; R52-V108 WeakPolarHBondContact CA-O 3.49Å
53	L	97.7	Very high	97.1	Very high	11 Å²	11	48.7 Å²	48.7	6%	0.058	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	113.2	174	173.7	67.3	0	0	0	109.5	H55 I59 V100 P107 V108 I110 V127	L53-H55 HydrophobicContact CD1-CB 4.09Å; L53-I59 HydrophobicContact CD1-CG1 4.29Å; L53-I59 HydrophobicContact CD1-CG2 4.02Å; L53-I59 HydrophobicContact CD2-CB 3.87Å; L53-I59 HydrophobicContact CD2-CG1 4.05Å; L53-I59 HydrophobicContact CD2-CG2 3.72Å; L53-V100 HydrophobicContact CD2-CB 4.29Å; L53-V100 HydrophobicContact CD2-CG1 4.21Å; L53-V100 HydrophobicContact CD2-CG2 4.16Å; L53-P107 WeakPolarHBondContact O-CA 3.26Å; L53-V108 HydrophobicContact CB-CB 4.19Å; L53-V108 PolarHBondContact N-O 2.83Å; L53-V108 PolarHBondContact O-N 2.81Å; L53-I110 HydrophobicContact CB-CD1 3.86Å; L53-V127 HydrophobicContact CD1-CG1 4.37Å
54	N	96.8	Very high	97	Very high	109 Å²	109	51.2 Å²	51.2	58%	0.583	27%	0.268	S	S	*	.			trans	-99.4	-17	178.4	-64.7	-57.4	0	0	0	113.5	D56 P107	N54-D56 PolarHBondContact O-N 2.76Å; N54-P107 WeakPolarHBondContact OD1-CB 2.94Å
55	H	94.6	Very high	96.9	Very high	83 Å²	83	51 Å²	51	38%	0.384	26%	0.261	S	S	.	.			trans	-65.1	128.3	-176.6	-77.4	-73.1	0	0	0	111	L36 H37 L53 I59 R106	L36-H55 HydrophobicContact CD1-CB 4.36Å; H37-H55 AromaticContact CD2-NE2 3.83Å; H37-H55 AromaticContact NE2-NE2 3.34Å; H37-H55 PolarHBondContact NE2-NE2 2.83Å; L53-H55 HydrophobicContact CD1-CB 4.09Å; H55-I59 HydrophobicContact CB-CD1 3.95Å; H55-I59 HydrophobicContact CB-CG1 4.35Å; H55-R106 PolarHBondContact O-NE 3.04Å; H55-R106 PolarHBondContact O-NH2 2.83Å
56	D	92.9	Very high	96.7	Very high	112 Å²	112	53 Å²	53	60%	0.599	27%	0.265	S	S	*	.			trans	-69.9	163.3	173.3	-70.1	-30.6	0	0	0	111.4	N54	N54-D56 PolarHBondContact O-N 2.76Å
57	G	93.8	Very high	96.7	Very high	2 Å²	2	56 Å²	56	2%	0.021	27%	0.267	C	S	.	.	S	Bend	trans	82.5	-173.6	178.3	0	0	0	0	0	114.3	I59 G102 R106	G57-I59 PolarHBondContact O-N 3.07Å; G57-G102 VanDerWaalsContact C-CA 3.44Å; G57-G102 WeakPolarHBondContact O-CA 3.46Å; G57-R106 PolarHBondContact O-NH2 2.69Å
58	R	96.4	Very high	96.5	Very high	82 Å²	82	52.6 Å²	52.6	31%	0.309	25%	0.254	S	S	.	.			trans	-78.8	116.9	-176.4	-173	179.9	-170.2	-135.9	1	109.3	V99 V100 D130	R58-V99 HydrophobicContact CG-CG1 3.88Å; R58-V99 VanDerWaalsContact CZ-CG1 3.5Å; R58-V99 VanDerWaalsContact NH2-CG1 3.33Å; R58-V100 WeakPolarHBondContact CA-O 3.39Å; R58-D130 HydrophobicContact CB-CB 4.13Å; R58-D130 HydrophobicContact CG-CB 4.15Å; R58-D130 IonicContact CZ-OD2 3.48Å; R58-D130 IonicContact NE-OD2 2.87Å; R58-D130 IonicContact NH1-OD2 3.94Å; R58-D130 PolarHBondContact NH1-OD2 2.82Å; R58-D130 PolarHBondContact O-N 2.96Å
59	I	97.8	Very high	96.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	137.7	-176.9	-59.8	-61.6	0	0	0	109.2	L36 L53 H55 G57 L61 V100 V127 F128 Y129	L36-I59 HydrophobicContact CD1-CD1 3.95Å; L53-I59 HydrophobicContact CD1-CG1 4.29Å; L53-I59 HydrophobicContact CD1-CG2 4.02Å; L53-I59 HydrophobicContact CD2-CB 3.87Å; L53-I59 HydrophobicContact CD2-CG1 4.05Å; L53-I59 HydrophobicContact CD2-CG2 3.72Å; H55-I59 HydrophobicContact CB-CD1 3.95Å; H55-I59 HydrophobicContact CB-CG1 4.35Å; G57-I59 PolarHBondContact O-N 3.07Å; I59-L61 HydrophobicContact CG2-CD2 4.24Å; I59-V100 HydrophobicContact CB-CB 4.33Å; I59-V100 PolarHBondContact N-O 3.18Å; I59-V100 PolarHBondContact O-N 3.21Å; I59-V127 HydrophobicContact CG2-CG1 3.57Å; I59-F128 CarbonylContact C-O 3.54Å; I59-F128 VanDerWaalsContact CA-O 3.3Å; I59-F128 WeakPolarHBondContact CA-O 3.37Å; I59-F128 WeakPolarHBondContact CG2-O 2.89Å; I59-Y129 HydrophobicContact CD1-CD2 3.8Å
60	I	97.8	Very high	96.4	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126	172.1	-55.1	85.7	0	0	0	108.8	W33 V97 V99 V127 F128 D130	W33-I60 HydrophobicContact CD2-CB 4.46Å; W33-I60 HydrophobicContact CD2-CD1 3.86Å; W33-I60 HydrophobicContact CD2-CG1 4.04Å; W33-I60 HydrophobicContact CE3-CB 4.28Å; W33-I60 HydrophobicContact CE3-CG1 4.31Å; W33-I60 HydrophobicContact CE3-CG2 4.18Å; W33-I60 HydrophobicContact CG-CD1 4.06Å; W33-I60 HydrophobicContact CH2-CB 4.39Å; W33-I60 HydrophobicContact CH2-CG1 4.08Å; W33-I60 HydrophobicContact CH2-CG2 3.76Å; W33-I60 HydrophobicContact CZ2-CD1 4.2Å; W33-I60 HydrophobicContact CZ2-CG1 3.73Å; W33-I60 HydrophobicContact CZ2-CG2 4.29Å; W33-I60 HydrophobicContact CZ3-CB 4.26Å; W33-I60 HydrophobicContact CZ3-CG1 4.34Å; W33-I60 HydrophobicContact CZ3-CG2 3.68Å; I60-V97 HydrophobicContact CG2-CG1 3.66Å; I60-V99 HydrophobicContact CG1-CG2 4.34Å; I60-V127 WeakPolarHBondContact O-CA 3.43Å; I60-F128 HydrophobicContact CB-CB 4.23Å; I60-F128 HydrophobicContact CD1-CB 4.39Å; I60-F128 PolarHBondContact N-O 2.69Å; I60-F128 PolarHBondContact O-N 3.33Å; I60-D130 HydrophobicContact CD1-CB 3.63Å
61	L	97.9	Very high	96.4	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	112.8	167.4	-55.1	176.4	0	0	0	106.9	I59 L72 V74 V97 V98 V100 I110 I125 V127	I59-L61 HydrophobicContact CG2-CD2 4.24Å; L61-L72 HydrophobicContact CB-CD2 3.81Å; L61-L72 HydrophobicContact CD1-CD2 4.02Å; L61-V74 HydrophobicContact CD1-CG2 3.8Å; L61-V97 WeakPolarHBondContact O-CA 3.36Å; L61-V98 HydrophobicContact CB-CB 4.49Å; L61-V98 PolarHBondContact N-O 3.28Å; L61-V98 PolarHBondContact O-N 2.82Å; L61-V100 HydrophobicContact CD1-CG2 3.94Å; L61-V100 HydrophobicContact CG-CG2 4.13Å; L61-I110 HydrophobicContact CD1-CD1 3.58Å; L61-I110 HydrophobicContact CD1-CG1 3.87Å; L61-I110 HydrophobicContact CD1-CG2 4.35Å; L61-I110 HydrophobicContact CD2-CD1 3.96Å; L61-I110 HydrophobicContact CG-CD1 4.44Å; L61-I125 HydrophobicContact CB-CG2 4.48Å; L61-I125 HydrophobicContact CD2-CG2 4.42Å; L61-V127 HydrophobicContact CD2-CG1 4.13Å; L61-V127 HydrophobicContact CD2-CG2 3.96Å
62	H	96.8	Very high	96.4	Very high	16 Å²	16	42.8 Å²	42.8	7%	0.074	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	101.8	175.7	-175.5	-80.5	0	0	0	108.4	H95 V97 R126 F128	H62-H95 AromaticContact CE1-CD2 3.44Å; H62-H95 PolarHBondContact CE1-CD2 2.91Å; H62-H95 VanDerWaalsContact CE1-CD2 3.44Å; H62-V97 VanDerWaalsContact CD2-CG2 3.43Å; H62-V97 WeakPolarHBondContact CD2-CG2 3.13Å; H62-R126 HydrophobicContact CB-CB 4.49Å; H62-R126 PolarHBondContact N-O 2.6Å; H62-R126 PolarHBondContact O-N 2.74Å; H62-F128 HydrophobicContact CB-CD2 4.2Å; H62-F128 HydrophobicContact CB-CE2 3.81Å
63	M	96.1	Very high	96.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	140.8	-178.2	-172.9	176.9	72.1	0	0	111	A70 L72 H95 D96 V112 F123 E124 I125	M63-A70 HydrophobicContact CE-CB 4.27Å; M63-A70 WeakPolarHBondContact CE-O 3.42Å; M63-A70 HydrophobicContact SD-CB 4.44Å; M63-L72 HydrophobicContact CE-CB 3.94Å; M63-L72 HydrophobicContact SD-CB 4.45Å; M63-L72 HydrophobicContact SD-CD1 4.3Å; M63-H95 CarbonylContact O-C 3.58Å; M63-H95 WeakPolarHBondContact O-CA 3.4Å; M63-D96 HydrophobicContact CB-CB 4.1Å; M63-D96 HydrophobicContact CE-CB 3.8Å; M63-D96 VanDerWaalsContact CE-OD2 3.26Å; M63-D96 WeakPolarHBondContact CE-OD2 3.18Å; M63-D96 PolarHBondContact N-O 2.83Å; M63-D96 PolarHBondContact O-N 3.45Å; M63-V112 HydrophobicContact SD-CG1 3.99Å; M63-F123 HydrophobicContact CG-CB 4.34Å; M63-F123 HydrophobicContact SD-CB 4.38Å; M63-F123 HydrophobicContact SD-CD2 4.3Å; M63-F123 HydrophobicContact SD-CG 4.44Å; M63-E124 CarbonylContact C-O 3.55Å; M63-E124 VanDerWaalsContact CA-O 3.25Å; M63-E124 WeakPolarHBondContact CA-O 3.34Å; M63-I125 HydrophobicContact CB-CG1 3.89Å; M63-I125 HydrophobicContact CG-CD1 4.47Å; M63-I125 HydrophobicContact CG-CG1 3.63Å; M63-I125 HydrophobicContact SD-CD1 4.18Å; M63-I125 HydrophobicContact SD-CG1 3.97Å
64	Q	95.4	Very high	96.4	Very high	62 Å²	62	35.3 Å²	35.3	29%	0.29	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	126.7	170.8	-176.4	179.3	-7.6	0	0	109	L66 F123 E124	Q64-L66 HydrophobicContact CG-CD2 4.4Å; Q64-L66 PolarHBondContact O-N 2.85Å; Q64-F123 CarbonylContact O-C 3.58Å; Q64-F123 VanDerWaalsContact O-CA 3.28Å; Q64-F123 WeakPolarHBondContact O-CA 3.47Å; Q64-E124 PolarHBondContact N-O 2.74Å; Q64-E124 PolarHBondContact O-N 2.86Å
65	S	96.1	Very high	96.5	Very high	23 Å²	23	30.3 Å²	30.3	16%	0.161	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	114.2	166	-68.1	0	0	0	0	109	A70 E122	S65-A70 PolarHBondContact OG-N 2.77Å; S65-A70 PolarHBondContact OG-O 3.38Å; S65-E122 CarbonylContact C-O 3.52Å
66	L	95.3	Very high	96.7	Very high	92 Å²	92	27.6 Å²	27.6	48%	0.482	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-30.9	176.4	-57	178.1	0	0	0	111.2	Q64 E122 E124	Q64-L66 HydrophobicContact CG-CD2 4.4Å; Q64-L66 PolarHBondContact O-N 2.85Å; L66-E122 HydrophobicContact CB-CB 4.27Å; L66-E122 PolarHBondContact N-O 3.15Å; L66-E124 HydrophobicContact CD1-CB 4.37Å
67	K	95.9	Very high	96.9	Very high	101 Å²	101	30.5 Å²	30.5	44%	0.439	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	148	175.2	176.1	-167.8	170	-155.7	0	108.5	E120 S121 E122	K67-E120 IonicContact NZ-OE2 3.35Å; K67-E120 PolarHBondContact NZ-OE2 2.84Å; K67-S121 CarbonylContact O-C 3.46Å; K67-S121 WeakPolarHBondContact O-CA 3.41Å; K67-E122 HydrophobicContact CB-CB 4.08Å; K67-E122 HydrophobicContact CB-CG 3.97Å; K67-E122 HydrophobicContact CD-CG 3.94Å; K67-E122 WeakPolarHBondContact CD-OE1 3.3Å; K67-E122 PolarHBondContact N-O 2.78Å; K67-E122 IonicContact NZ-OE1 3.94Å; K67-E122 PolarHBondContact NZ-OE1 3.44Å; K67-E122 PolarHBondContact O-N 2.9Å
68	G	95.8	Very high	97.2	Very high	25 Å²	25	32.8 Å²	32.8	26%	0.258	16%	0.162	S	C	.	.	S	Bend	trans	70.5	-147.8	-176.8	0	0	0	0	0	111.5
69	D	96.4	Very high	97.3	Very high	9 Å²	9	31 Å²	31	5%	0.048	16%	0.158	C	C	.	.			trans	-144.3	110.5	179.1	-166.9	16.6	0	0	0	108.3	C93 H115 Y118 S121	D69-C93 PolarHBondContact OD2-SG 3.35Å; D69-C93 VanDerWaalsContact OD2-SG 3.35Å; D69-H115 HydrophobicContact CB-CB 3.89Å; D69-H115 WeakPolarHBondContact O-CB 3.4Å; D69-H115 PolarHBondContact O-N 2.75Å; D69-Y118 HydrophobicContact CB-CD2 3.52Å; D69-Y118 HydrophobicContact CB-CE2 3.37Å; D69-S121 VanDerWaalsContact C-OG 3.25Å; D69-S121 PolarHBondContact N-OG 2.82Å; D69-S121 PolarHBondContact O-OG 3.35Å
70	A	97.1	Very high	97.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	134.7	176.4	0	0	0	0	0	108.5	M63 S65 V112 Y113 F123	M63-A70 HydrophobicContact CE-CB 4.27Å; M63-A70 WeakPolarHBondContact CE-O 3.42Å; M63-A70 HydrophobicContact SD-CB 4.44Å; S65-A70 PolarHBondContact OG-N 2.77Å; S65-A70 PolarHBondContact OG-O 3.38Å; A70-V112 HydrophobicContact CB-CG1 4.01Å; A70-Y113 CarbonylContact C-O 3.52Å; A70-Y113 VanDerWaalsContact CA-O 3.28Å; A70-Y113 WeakPolarHBondContact CA-O 3.25Å; A70-F123 HydrophobicContact CB-CB 3.99Å; A70-F123 HydrophobicContact CB-CD1 4.12Å; A70-F123 HydrophobicContact CB-CG 4.3Å
71	D	97	Very high	97.3	Very high	7 Å²	7	35.9 Å²	35.9	4%	0.037	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	144	-174.6	-74.5	-42.2	0	0	0	110.7	Y73 V91 V112 Y113 H115	D71-Y73 HydrophobicContact CB-CE2 3.79Å; D71-V91 HydrophobicContact CB-CB 4.39Å; D71-V91 HydrophobicContact CB-CG1 3.92Å; D71-V91 WeakPolarHBondContact OD1-CA 3.28Å; D71-V91 WeakPolarHBondContact OD1-CB 3.45Å; D71-V112 CarbonylContact O-C 3.59Å; D71-V112 WeakPolarHBondContact O-CA 3.39Å; D71-Y113 HydrophobicContact CB-CD1 4.36Å; D71-Y113 PolarHBondContact N-O 2.94Å; D71-Y113 PolarHBondContact O-N 2.98Å; D71-H115 IonicContact OD2-CD2 2.7Å
72	L	98	Very high	97.3	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	129.9	-175.9	-166.1	68	0	0	0	112.9	L61 M63 V74 Q89 S90 V98 I110 V112 I125	L61-L72 HydrophobicContact CB-CD2 3.81Å; L61-L72 HydrophobicContact CD1-CD2 4.02Å; M63-L72 HydrophobicContact CE-CB 3.94Å; M63-L72 HydrophobicContact SD-CB 4.45Å; M63-L72 HydrophobicContact SD-CD1 4.3Å; L72-V74 HydrophobicContact CD2-CG2 4.48Å; L72-V74 HydrophobicContact CG-CG2 4.26Å; L72-Q89 CarbonylContact O-C 3.51Å; L72-Q89 WeakPolarHBondContact O-CA 3.44Å; L72-Q89 WeakPolarHBondContact O-CB 3.45Å; L72-S90 PolarHBondContact N-O 2.78Å; L72-S90 PolarHBondContact O-N 2.93Å; L72-V98 HydrophobicContact CD2-CB 3.96Å; L72-V98 HydrophobicContact CD2-CG2 3.74Å; L72-V98 HydrophobicContact CG-CG2 4.39Å; L72-I110 HydrophobicContact CD1-CG2 3.47Å; L72-I110 VanDerWaalsContact CD1-CG2 3.47Å; L72-I110 HydrophobicContact CG-CG2 4.5Å; L72-V112 HydrophobicContact CD1-CG2 4.04Å; L72-I125 HydrophobicContact CD1-CD1 4.29Å
73	Y	98.5	Very high	97.2	Very high	17 Å²	17	42.4 Å²	42.4	7%	0.067	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	137.4	175.2	-60.1	-90.4	0	0	0	110.6	Y48 D71 P81 F83 Y86 Q89 V91 I110 G111 Y113	Y48-Y73 HydrophobicContact CE1-CD2 4.19Å; D71-Y73 HydrophobicContact CB-CE2 3.79Å; Y73-P81 WeakPolarHBondContact O-CG 3.45Å; Y73-F83 VanDerWaalsContact CE1-CA 3.5Å; Y73-F83 HydrophobicContact CE1-CB 4.01Å; Y73-Y86 AromaticContact CD1-CD1 3.86Å; Y73-Y86 HydrophobicContact CD1-CD1 3.86Å; Y73-Y86 HydrophobicContact CD1-CE1 4.47Å; Y73-Y86 AromaticContact CD1-CG 3.94Å; Y73-Y86 HydrophobicContact CD1-CG 3.94Å; Y73-Y86 HydrophobicContact CE1-CD1 4.28Å; Y73-Y86 HydrophobicContact CE1-CE1 4.49Å; Y73-Q89 HydrophobicContact CD1-CB 3.93Å; Y73-Q89 HydrophobicContact CE1-CB 4.23Å; Y73-V91 HydrophobicContact CE1-CG1 4.16Å; Y73-V91 HydrophobicContact CE2-CG1 4.35Å; Y73-I110 CarbonylContact O-C 3.58Å; Y73-I110 WeakPolarHBondContact O-CA 3.46Å; Y73-G111 PolarHBondContact N-O 3.44Å; Y73-G111 PolarHBondContact O-N 3.33Å; Y73-Y113 HydrophobicContact CE2-CG 4.43Å
74	V	98.8	Very high	97.2	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	139.3	-173.6	-176.3	0	0	0	0	111.5	L61 L72 K87 L88 V98 V100 V108 G109 I110	L61-V74 HydrophobicContact CD1-CG2 3.8Å; L72-V74 HydrophobicContact CD2-CG2 4.48Å; L72-V74 HydrophobicContact CG-CG2 4.26Å; V74-K87 PolarHBondContact O-N 3.35Å; V74-L88 HydrophobicContact CB-CB 4.23Å; V74-L88 PolarHBondContact N-O 2.78Å; V74-L88 PolarHBondContact O-N 2.82Å; V74-V98 HydrophobicContact CB-CG1 4.39Å; V74-V98 HydrophobicContact CG2-CB 4.46Å; V74-V98 HydrophobicContact CG2-CG1 3.9Å; V74-V100 HydrophobicContact CG1-CG2 4.07Å; V74-V108 HydrophobicContact CG1-CG1 3.29Å; V74-G109 WeakPolarHBondContact CA-O 2.84Å; V74-I110 HydrophobicContact CG2-CG1 4.37Å
75	S	98.6	Very high	97.3	Very high	4 Å²	4	48.6 Å²	48.6	3%	0.028	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	141.6	178	-171.7	0	0	0	0	112.5	K77 G109	S75-K77 PolarHBondContact OG-N 2.82Å; S75-K77 VanDerWaalsContact OG-N 3.13Å; S75-G109 PolarHBondContact N-O 3.34Å; S75-G109 PolarHBondContact O-N 2.78Å
76	D	98.3	Very high	97.4	Very high	26 Å²	26	52.1 Å²	52.1	14%	0.139	26%	0.259	C	S	.	.	S	Bend	trans	-94.8	-0.8	167.5	66.3	-15.2	0	0	0	112.6	K87 F104 K105 V108	D76-K87 WeakPolarHBondContact OD1-CD 3.43Å; D76-K87 WeakPolarHBondContact OD1-CE 3.4Å; D76-K87 IonicContact OD1-NZ 2.59Å; D76-K87 PolarHBondContact OD1-NZ 2.86Å; D76-K87 IonicContact OD2-NZ 3.54Å; D76-K87 PolarHBondContact OD2-NZ 2.83Å; D76-F104 HydrophobicContact CB-CB 3.97Å; D76-F104 HydrophobicContact CB-CD2 3.76Å; D76-F104 HydrophobicContact CB-CG 3.93Å; D76-K105 HydrophobicContact CB-CB 4.27Å; D76-K105 WeakPolarHBondContact CB-O 3.07Å; D76-V108 HydrophobicContact CB-CG2 4.19Å
77	K	98.1	Very high	97.6	Very high	174 Å²	174	51.8 Å²	51.8	76%	0.757	25%	0.254	S	S	*	.	S	Bend	trans	-95.5	-24	178.9	-70.4	179.5	175.1	177.6	0	112.9	S75	S75-K77 PolarHBondContact OG-N 2.82Å; S75-K77 VanDerWaalsContact OG-N 3.13Å
78	T	98.3	Very high	97.7	Very high	50 Å²	50	49.3 Å²	49.3	31%	0.307	25%	0.246	S	C	.	.			trans	-146.4	148	-178.6	178.2	0	0	0	0	110	H80 P81	T78-H80 VanDerWaalsContact C-N 3.28Å; T78-H80 PolarHBondContact OG1-N 2.7Å; T78-H80 VanDerWaalsContact OG1-N 3.12Å; T78-P81 HydrophobicContact CG2-CB 4.34Å
79	L	98.6	Very high	97.8	Very high	45 Å²	45	51.8 Å²	51.8	24%	0.236	25%	0.25	C	S	.	.	S	Bend	trans	-84.2	-4.3	173.1	-62	179.3	0	0	0	113.4	R52 P81 P107	R52-L79 HydrophobicContact CG-CD2 4.39Å; L79-P81 VanDerWaalsContact C-CD 3.43Å; L79-P107 HydrophobicContact CD1-CG 4.5Å; L79-P107 HydrophobicContact CD2-CB 3.97Å; L79-P107 HydrophobicContact CD2-CG 3.94Å
80	H	98.5	Very high	97.8	Very high	102 Å²	102	52.2 Å²	52.2	47%	0.472	25%	0.254	S	S	.	.	S	Bend	trans	-127.6	62.4	179.9	-52.4	92.7	0	0	0	110.6	Y50 T78	Y50-H80 HydrophobicContact CD1-CB 4.14Å; Y50-H80 AromaticContact CD2-CD2 3.66Å; Y50-H80 VanDerWaalsContact CE1-CA 3.45Å; Y50-H80 HydrophobicContact CE1-CB 3.78Å; Y50-H80 HydrophobicContact CE2-CB 4.49Å; Y50-H80 AromaticContact CE2-CD2 3.9Å; Y50-H80 AromaticContact CG-CD2 3.75Å; T78-H80 VanDerWaalsContact C-N 3.28Å; T78-H80 PolarHBondContact OG1-N 2.7Å; T78-H80 VanDerWaalsContact OG1-N 3.12Å
81	P	98.4	Very high	97.7	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.271	C	S	.	.			trans	-67.2	144.6	176.2	31	-35.7	0	0	0	110.9	Y50 Y73 T78 L79 T85	Y50-P81 WeakPolarHBondContact CE1-O 3.15Å; Y73-P81 WeakPolarHBondContact O-CG 3.45Å; T78-P81 HydrophobicContact CG2-CB 4.34Å; L79-P81 VanDerWaalsContact C-CD 3.43Å; P81-T85 WeakPolarHBondContact CA-O 3.43Å; P81-T85 VanDerWaalsContact CB-O 3.31Å; P81-T85 WeakPolarHBondContact CB-O 3.38Å
82	N	97.6	Very high	97.4	Very high	45 Å²	45	57.7 Å²	57.7	24%	0.241	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-136.9	-174.1	177.9	62.7	36.3	0	0	0	110.4	Y48 D84 T85 Y86	Y48-N82 HydrophobicContact CE1-CB 4Å; Y48-N82 HydrophobicContact CE2-CB 4.14Å; N82-D84 PolarHBondContact O-N 2.84Å; N82-D84 VanDerWaalsContact O-N 3.14Å; N82-D84 PolarHBondContact OD1-N 3.19Å; N82-T85 PolarHBondContact N-O 3.11Å; N82-T85 PolarHBondContact ND2-OG1 3.13Å; N82-T85 CarbonylContact O-C 3.56Å; N82-T85 PolarHBondContact O-N 3.22Å; N82-T85 VanDerWaalsContact O-N 3.11Å; N82-T85 PolarHBondContact OD1-N 2.9Å; N82-T85 PolarHBondContact OD1-OG1 3.35Å; N82-Y86 WeakPolarHBondContact O-CD1 3.38Å
83	F	95.4	Very high	96.3	Very high	109 Å²	109	63 Å²	63	48%	0.478	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-20	-177.5	71.8	-101.1	0	0	0	114.5	Y48 Y73 Y86	Y48-F83 WeakPolarHBondContact OH-CD1 3.34Å; Y48-F83 PolarHBondContact OH-N 3.22Å; Y73-F83 VanDerWaalsContact CE1-CA 3.5Å; Y73-F83 HydrophobicContact CE1-CB 4.01Å; F83-Y86 VanDerWaalsContact O-CE1 3.29Å; F83-Y86 WeakPolarHBondContact O-CE1 3.36Å
84	D	96.1	Very high	95.3	Very high	121 Å²	121	63.8 Å²	63.8	65%	0.647	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-22	175.9	-71.4	-39.7	0	0	0	112.8	N82	N82-D84 PolarHBondContact O-N 2.84Å; N82-D84 VanDerWaalsContact O-N 3.14Å; N82-D84 PolarHBondContact OD1-N 3.19Å
85	T	97.1	Very high	94.7	Very high	71 Å²	71	68.6 Å²	68.6	44%	0.436	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-133.3	82.6	-168.8	56.7	0	0	0	0	111.9	P81 N82	P81-T85 WeakPolarHBondContact CA-O 3.43Å; P81-T85 VanDerWaalsContact CB-O 3.31Å; P81-T85 WeakPolarHBondContact CB-O 3.38Å; N82-T85 PolarHBondContact N-O 3.11Å; N82-T85 PolarHBondContact ND2-OG1 3.13Å; N82-T85 CarbonylContact O-C 3.56Å; N82-T85 PolarHBondContact O-N 3.22Å; N82-T85 VanDerWaalsContact O-N 3.11Å; N82-T85 PolarHBondContact OD1-N 2.9Å; N82-T85 PolarHBondContact OD1-OG1 3.35Å
86	Y	98.3	Very high	94.4	Very high	96 Å²	96	68.4 Å²	68.4	38%	0.376	36%	0.358	S	S	.	.			trans	-142.6	166	178.6	64.1	-84.3	0	0	0	110.9	Y73 N82 F83 Q89	Y73-Y86 AromaticContact CD1-CD1 3.86Å; Y73-Y86 HydrophobicContact CD1-CD1 3.86Å; Y73-Y86 HydrophobicContact CD1-CE1 4.47Å; Y73-Y86 AromaticContact CD1-CG 3.94Å; Y73-Y86 HydrophobicContact CD1-CG 3.94Å; Y73-Y86 HydrophobicContact CE1-CD1 4.28Å; Y73-Y86 HydrophobicContact CE1-CE1 4.49Å; N82-Y86 WeakPolarHBondContact O-CD1 3.38Å; F83-Y86 VanDerWaalsContact O-CE1 3.29Å; F83-Y86 WeakPolarHBondContact O-CE1 3.36Å; Y86-Q89 HydrophobicContact CD2-CB 3.86Å; Y86-Q89 HydrophobicContact CD2-CG 4.11Å; Y86-Q89 VanDerWaalsContact CE1-OE1 3.28Å; Y86-Q89 HydrophobicContact CE2-CB 3.92Å; Y86-Q89 VanDerWaalsContact CE2-CD 3.44Å; Y86-Q89 HydrophobicContact CE2-CG 3.62Å; Y86-Q89 VanDerWaalsContact CZ-CD 3.43Å; Y86-Q89 PolarHBondContact OH-OE1 2.84Å; Y86-Q89 VanDerWaalsContact OH-OE1 3.12Å
87	K	98.3	Very high	94.3	Very high	85 Å²	85	70 Å²	70	37%	0.37	37%	0.369	S	S	.	.	S	Bend	trans	-106.9	-37.4	167.5	-82.4	-159.1	178.7	172.1	0	112.1	V74 D76 F104	V74-K87 PolarHBondContact O-N 3.35Å; D76-K87 WeakPolarHBondContact OD1-CD 3.43Å; D76-K87 WeakPolarHBondContact OD1-CE 3.4Å; D76-K87 IonicContact OD1-NZ 2.59Å; D76-K87 PolarHBondContact OD1-NZ 2.86Å; D76-K87 IonicContact OD2-NZ 3.54Å; D76-K87 PolarHBondContact OD2-NZ 2.83Å; K87-F104 HydrophobicContact CB-CE2 4.21Å; K87-F104 HydrophobicContact CB-CZ 4.05Å; K87-F104 HydrophobicContact CD-CE1 4.35Å; K87-F104 HydrophobicContact CD-CE2 4.23Å; K87-F104 HydrophobicContact CD-CZ 3.84Å
88	L	98.3	Very high	94.3	Very high	50 Å²	50	62 Å²	62	26%	0.262	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	151.2	177.6	-50.1	168.7	0	0	0	108.8	V74 V98 V99 F104	V74-L88 HydrophobicContact CB-CB 4.23Å; V74-L88 PolarHBondContact N-O 2.78Å; V74-L88 PolarHBondContact O-N 2.82Å; L88-V98 HydrophobicContact CB-CG1 3.73Å; L88-V98 HydrophobicContact CD1-CG1 3.92Å; L88-V98 HydrophobicContact CG-CG1 4.48Å; L88-V99 WeakPolarHBondContact CD1-O 3.34Å; L88-F104 HydrophobicContact CD1-CE2 3.66Å; L88-F104 HydrophobicContact CD1-CZ 3.62Å; L88-F104 HydrophobicContact CD2-CZ 4.35Å; L88-F104 HydrophobicContact CG-CE2 4.06Å; L88-F104 HydrophobicContact CG-CZ 3.82Å
89	Q	97.9	Very high	94.2	Very high	76 Å²	76	62 Å²	62	36%	0.355	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	159.7	175.6	70.6	176.5	23	0	0	111.2	L72 Y73 Y86 V91	L72-Q89 CarbonylContact O-C 3.51Å; L72-Q89 WeakPolarHBondContact O-CA 3.44Å; L72-Q89 WeakPolarHBondContact O-CB 3.45Å; Y73-Q89 HydrophobicContact CD1-CB 3.93Å; Y73-Q89 HydrophobicContact CE1-CB 4.23Å; Y86-Q89 HydrophobicContact CD2-CB 3.86Å; Y86-Q89 HydrophobicContact CD2-CG 4.11Å; Y86-Q89 VanDerWaalsContact CE1-OE1 3.28Å; Y86-Q89 HydrophobicContact CE2-CB 3.92Å; Y86-Q89 VanDerWaalsContact CE2-CD 3.44Å; Y86-Q89 HydrophobicContact CE2-CG 3.62Å; Y86-Q89 VanDerWaalsContact CZ-CD 3.43Å; Y86-Q89 PolarHBondContact OH-OE1 2.84Å; Y86-Q89 VanDerWaalsContact OH-OE1 3.12Å; Q89-V91 HydrophobicContact CB-CG1 4.49Å
90	S	97.4	Very high	94.2	Very high	18 Å²	18	59.8 Å²	59.8	13%	0.126	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	128	160.4	-170.9	0	0	0	0	107.4	L72 D96	L72-S90 PolarHBondContact N-O 2.78Å; L72-S90 PolarHBondContact O-N 2.93Å; S90-D96 VanDerWaalsContact C-OD1 3.27Å; S90-D96 WeakPolarHBondContact CB-OD1 3.3Å; S90-D96 WeakPolarHBondContact OG-CA 3.31Å; S90-D96 PolarHBondContact OG-OD1 2.8Å
91	V	94.9	Very high	94.1	Very high	59 Å²	59	56.8 Å²	56.8	36%	0.358	31%	0.312	S	S	.	.			trans	-135.8	51.4	-168.6	-62.9	0	0	0	0	110.7	D71 Y73 Q89 D96	D71-V91 HydrophobicContact CB-CB 4.39Å; D71-V91 HydrophobicContact CB-CG1 3.92Å; D71-V91 WeakPolarHBondContact OD1-CA 3.28Å; D71-V91 WeakPolarHBondContact OD1-CB 3.45Å; Y73-V91 HydrophobicContact CE1-CG1 4.16Å; Y73-V91 HydrophobicContact CE2-CG1 4.35Å; Q89-V91 HydrophobicContact CB-CG1 4.49Å; V91-D96 PolarHBondContact N-OD1 2.89Å
92	T	89.9	Confident	93.9	Very high	64 Å²	64	58.3 Å²	58.3	39%	0.393	33%	0.327	S	S	.	.			trans	-108.1	147.6	-173.6	72	0	0	0	0	110.3	G94 H95 D96	T92-G94 PolarHBondContact O-N 3.36Å; T92-H95 PolarHBondContact OG1-O 3.06Å; T92-D96 WeakPolarHBondContact CB-OD1 3.29Å; T92-D96 PolarHBondContact N-OD1 2.91Å; T92-D96 PolarHBondContact OG1-OD1 3.26Å
93	C	75	Confident	93.8	Very high	112 Å²	112	62.5 Å²	62.5	76%	0.757	35%	0.35	S	S	*	.	S	Bend	trans	-75.6	35.3	179.6	-49.9	0	0	0	0	113.5	D69	D69-C93 PolarHBondContact OD2-SG 3.35Å; D69-C93 VanDerWaalsContact OD2-SG 3.35Å
94	G	76.6	Confident	93.8	Very high	33 Å²	33	58.2 Å²	58.2	34%	0.34	33%	0.331	S	S	.	.	S	Bend	trans	-157.4	-127.3	-170.3	0	0	0	0	0	113	T92	T92-G94 PolarHBondContact O-N 3.36Å
95	H	87.3	Confident	93.9	Very high	100 Å²	100	60 Å²	60	46%	0.463	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	117	174.8	-66.1	106.6	0	0	0	110	H62 M63 T92	H62-H95 AromaticContact CE1-CD2 3.44Å; H62-H95 PolarHBondContact CE1-CD2 2.91Å; H62-H95 VanDerWaalsContact CE1-CD2 3.44Å; M63-H95 CarbonylContact O-C 3.58Å; M63-H95 WeakPolarHBondContact O-CA 3.4Å; T92-H95 PolarHBondContact OG1-O 3.06Å
96	D	92.7	Very high	93.9	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	116.2	177.9	-82.7	-37.8	0	0	0	110.6	M63 S90 V91 T92	M63-D96 HydrophobicContact CB-CB 4.1Å; M63-D96 HydrophobicContact CE-CB 3.8Å; M63-D96 VanDerWaalsContact CE-OD2 3.26Å; M63-D96 WeakPolarHBondContact CE-OD2 3.18Å; M63-D96 PolarHBondContact N-O 2.83Å; M63-D96 PolarHBondContact O-N 3.45Å; S90-D96 VanDerWaalsContact C-OD1 3.27Å; S90-D96 WeakPolarHBondContact CB-OD1 3.3Å; S90-D96 WeakPolarHBondContact OG-CA 3.31Å; S90-D96 PolarHBondContact OG-OD1 2.8Å; V91-D96 PolarHBondContact N-OD1 2.89Å; T92-D96 WeakPolarHBondContact CB-OD1 3.29Å; T92-D96 PolarHBondContact N-OD1 2.91Å; T92-D96 PolarHBondContact OG1-OD1 3.26Å
97	V	95.6	Very high	93.9	Very high	61 Å²	61	56.5 Å²	56.5	37%	0.37	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	119.9	-177.2	-172	0	0	0	0	110.1	I60 L61 H62	I60-V97 HydrophobicContact CG2-CG1 3.66Å; L61-V97 WeakPolarHBondContact O-CA 3.36Å; H62-V97 VanDerWaalsContact CD2-CG2 3.43Å; H62-V97 WeakPolarHBondContact CD2-CG2 3.13Å
98	V	97.4	Very high	93.9	Very high	6 Å²	6	52.5 Å²	52.5	4%	0.036	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	123	173.1	175.5	0	0	0	0	109.6	L61 L72 V74 L88 V100	L61-V98 HydrophobicContact CB-CB 4.49Å; L61-V98 PolarHBondContact N-O 3.28Å; L61-V98 PolarHBondContact O-N 2.82Å; L72-V98 HydrophobicContact CD2-CB 3.96Å; L72-V98 HydrophobicContact CD2-CG2 3.74Å; L72-V98 HydrophobicContact CG-CG2 4.39Å; V74-V98 HydrophobicContact CB-CG1 4.39Å; V74-V98 HydrophobicContact CG2-CB 4.46Å; V74-V98 HydrophobicContact CG2-CG1 3.9Å; L88-V98 HydrophobicContact CB-CG1 3.73Å; L88-V98 HydrophobicContact CD1-CG1 3.92Å; L88-V98 HydrophobicContact CG-CG1 4.48Å; V98-V100 HydrophobicContact CG1-CG2 4.4Å
99	V	97.3	Very high	93.9	Very high	48 Å²	48	50.1 Å²	50.1	29%	0.291	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	112.1	171.5	177.9	0	0	0	0	108.6	R58 I60 L88 P101	R58-V99 HydrophobicContact CG-CG1 3.88Å; R58-V99 VanDerWaalsContact CZ-CG1 3.5Å; R58-V99 VanDerWaalsContact NH2-CG1 3.33Å; I60-V99 HydrophobicContact CG1-CG2 4.34Å; L88-V99 WeakPolarHBondContact CD1-O 3.34Å; V99-P101 WeakPolarHBondContact O-CD 3.35Å
100	V	98.1	Very high	94	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	117.2	173.7	-170.8	0	0	0	0	109.3	L53 R58 I59 L61 V74 V98 F104 V108	L53-V100 HydrophobicContact CD2-CB 4.29Å; L53-V100 HydrophobicContact CD2-CG1 4.21Å; L53-V100 HydrophobicContact CD2-CG2 4.16Å; R58-V100 WeakPolarHBondContact CA-O 3.39Å; I59-V100 HydrophobicContact CB-CB 4.33Å; I59-V100 PolarHBondContact N-O 3.18Å; I59-V100 PolarHBondContact O-N 3.21Å; L61-V100 HydrophobicContact CD1-CG2 3.94Å; L61-V100 HydrophobicContact CG-CG2 4.13Å; V74-V100 HydrophobicContact CG1-CG2 4.07Å; V98-V100 HydrophobicContact CG1-CG2 4.4Å; V100-F104 HydrophobicContact CG1-CB 4.26Å; V100-F104 HydrophobicContact CG1-CD2 3.84Å; V100-F104 HydrophobicContact CG1-CG 4.26Å; V100-V108 HydrophobicContact CG1-CG1 4.19Å; V100-V108 HydrophobicContact CG1-CG2 4.09Å
101	P	96.7	Very high	94	Very high	38 Å²	38	46 Å²	46	25%	0.247	27%	0.267	C	S	.	.			trans	-61	157.1	176.7	-27	38.3	0	0	0	113.7	V99 D103 F104 R106	V99-P101 WeakPolarHBondContact O-CD 3.35Å; P101-D103 WeakPolarHBondContact CB-OD1 3.41Å; P101-F104 HydrophobicContact CB-CD1 3.84Å; P101-F104 HydrophobicContact CB-CE1 4.17Å; P101-F104 HydrophobicContact CG-CD1 3.84Å; P101-F104 HydrophobicContact CG-CE1 3.66Å; P101-F104 HydrophobicContact CG-CZ 4.31Å; P101-R106 PolarHBondContact O-NH1 3.44Å; P101-R106 VanDerWaalsContact O-NH1 3.07Å; P101-R106 PolarHBondContact O-NH2 3.18Å
102	G	94.5	Very high	94.2	Very high	32 Å²	32	43.2 Å²	43.2	33%	0.33	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-25.7	177.6	0	0	0	0	0	114.3	G57 F104	G57-G102 VanDerWaalsContact C-CA 3.44Å; G57-G102 WeakPolarHBondContact O-CA 3.46Å; G102-F104 VanDerWaalsContact C-N 3.34Å
103	D	94.1	Very high	94.5	Very high	133 Å²	133	41.7 Å²	41.7	71%	0.711	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-10.1	178.8	65.7	-38	0	0	0	113.5	P101 K105	P101-D103 WeakPolarHBondContact CB-OD1 3.41Å; D103-K105 PolarHBondContact O-N 3.18Å
104	F	97	Very high	95.6	Very high	20 Å²	20	36.3 Å²	36.3	9%	0.088	20%	0.201	C	C	.	.	S	Bend	trans	-61.2	125.7	174.2	-95.5	40	0	0	0	110.7	D76 K87 L88 V100 P101 G102 R106 V108	D76-F104 HydrophobicContact CB-CB 3.97Å; D76-F104 HydrophobicContact CB-CD2 3.76Å; D76-F104 HydrophobicContact CB-CG 3.93Å; K87-F104 HydrophobicContact CB-CE2 4.21Å; K87-F104 HydrophobicContact CB-CZ 4.05Å; K87-F104 HydrophobicContact CD-CE1 4.35Å; K87-F104 HydrophobicContact CD-CE2 4.23Å; K87-F104 HydrophobicContact CD-CZ 3.84Å; L88-F104 HydrophobicContact CD1-CE2 3.66Å; L88-F104 HydrophobicContact CD1-CZ 3.62Å; L88-F104 HydrophobicContact CD2-CZ 4.35Å; L88-F104 HydrophobicContact CG-CE2 4.06Å; L88-F104 HydrophobicContact CG-CZ 3.82Å; V100-F104 HydrophobicContact CG1-CB 4.26Å; V100-F104 HydrophobicContact CG1-CD2 3.84Å; V100-F104 HydrophobicContact CG1-CG 4.26Å; P101-F104 HydrophobicContact CB-CD1 3.84Å; P101-F104 HydrophobicContact CB-CE1 4.17Å; P101-F104 HydrophobicContact CG-CD1 3.84Å; P101-F104 HydrophobicContact CG-CE1 3.66Å; P101-F104 HydrophobicContact CG-CZ 4.31Å; G102-F104 VanDerWaalsContact C-N 3.34Å; F104-R106 PolarHBondContact O-N 2.9Å; F104-R106 VanDerWaalsContact O-N 3.15Å; F104-R106 PolarHBondContact O-NH1 3.48Å; F104-V108 HydrophobicContact CB-CG2 3.86Å; F104-V108 HydrophobicContact CD2-CG2 4.03Å; F104-V108 HydrophobicContact CG-CG2 4.48Å
105	K	97.1	Very high	96.5	Very high	159 Å²	159	37.9 Å²	37.9	69%	0.691	20%	0.199	S	C	*	.	P	Polyproline II helix	trans	-57.3	120.3	178.5	-175.4	178.7	178.4	178.2	0	110.8	D76 D103 P107	D76-K105 HydrophobicContact CB-CB 4.27Å; D76-K105 WeakPolarHBondContact CB-O 3.07Å; D103-K105 PolarHBondContact O-N 3.18Å; K105-P107 CarbonylContact O-C 3.54Å
106	R	97.3	Very high	97	Very high	40 Å²	40	36.8 Å²	36.8	15%	0.151	20%	0.201	C	C	.	.	S	Bend	trans	-84.7	148.5	175.7	-58.8	-53.5	-167.8	-112.9	7.6	111.2	H55 G57 P101 F104 V108	H55-R106 PolarHBondContact O-NE 3.04Å; H55-R106 PolarHBondContact O-NH2 2.83Å; G57-R106 PolarHBondContact O-NH2 2.69Å; P101-R106 PolarHBondContact O-NH1 3.44Å; P101-R106 VanDerWaalsContact O-NH1 3.07Å; P101-R106 PolarHBondContact O-NH2 3.18Å; F104-R106 PolarHBondContact O-N 2.9Å; F104-R106 VanDerWaalsContact O-N 3.15Å; F104-R106 PolarHBondContact O-NH1 3.48Å; R106-V108 VanDerWaalsContact NH1-CG2 3.35Å
107	P	98.1	Very high	97.2	Very high	53 Å²	53	41.1 Å²	41.1	34%	0.344	23%	0.232	S	C	.	.	S	Bend	cis	-67.4	139.1	-7.7	20.3	-26.7	0	0	0	113.3	R52 L53 N54 L79 K105	R52-P107 HydrophobicContact CB-CB 4.5Å; L53-P107 WeakPolarHBondContact O-CA 3.26Å; N54-P107 WeakPolarHBondContact OD1-CB 2.94Å; L79-P107 HydrophobicContact CD1-CG 4.5Å; L79-P107 HydrophobicContact CD2-CB 3.97Å; L79-P107 HydrophobicContact CD2-CG 3.94Å; K105-P107 CarbonylContact O-C 3.54Å
108	V	98.6	Very high	97.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	129.8	169.3	169.2	0	0	0	0	108.8	R52 L53 V74 D76 V100 F104 R106	R52-V108 WeakPolarHBondContact CA-O 3.49Å; L53-V108 HydrophobicContact CB-CB 4.19Å; L53-V108 PolarHBondContact N-O 2.83Å; L53-V108 PolarHBondContact O-N 2.81Å; V74-V108 HydrophobicContact CG1-CG1 3.29Å; D76-V108 HydrophobicContact CB-CG2 4.19Å; V100-V108 HydrophobicContact CG1-CG1 4.19Å; V100-V108 HydrophobicContact CG1-CG2 4.09Å; F104-V108 HydrophobicContact CB-CG2 3.86Å; F104-V108 HydrophobicContact CD2-CG2 4.03Å; F104-V108 HydrophobicContact CG-CG2 4.48Å; R106-V108 VanDerWaalsContact NH1-CG2 3.35Å
109	G	98.7	Very high	97.2	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	135.2	170.9	0	0	0	0	0	111.2	V74 S75	V74-G109 WeakPolarHBondContact CA-O 2.84Å; S75-G109 PolarHBondContact N-O 3.34Å; S75-G109 PolarHBondContact O-N 2.78Å
110	I	98.8	Very high	97.2	Very high	8 Å²	8	53.2 Å²	53.2	4%	0.041	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125.8	174.2	-59.6	164.6	0	0	0	107.1	Y50 L51 L53 L61 L72 Y73 V74	Y50-I110 CarbonylContact C-O 3.52Å; Y50-I110 VanDerWaalsContact CA-O 3.3Å; Y50-I110 WeakPolarHBondContact CA-O 3.4Å; L51-I110 HydrophobicContact CB-CB 4.15Å; L51-I110 PolarHBondContact N-O 3.08Å; L51-I110 PolarHBondContact O-N 3.17Å; L53-I110 HydrophobicContact CB-CD1 3.86Å; L61-I110 HydrophobicContact CD1-CD1 3.58Å; L61-I110 HydrophobicContact CD1-CG1 3.87Å; L61-I110 HydrophobicContact CD1-CG2 4.35Å; L61-I110 HydrophobicContact CD2-CD1 3.96Å; L61-I110 HydrophobicContact CG-CD1 4.44Å; L72-I110 HydrophobicContact CD1-CG2 3.47Å; L72-I110 VanDerWaalsContact CD1-CG2 3.47Å; L72-I110 HydrophobicContact CG-CG2 4.5Å; Y73-I110 CarbonylContact O-C 3.58Å; Y73-I110 WeakPolarHBondContact O-CA 3.46Å; V74-I110 HydrophobicContact CG2-CG1 4.37Å
111	G	98.4	Very high	97.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	126.7	174.1	0	0	0	0	0	109.3	Y73	Y73-G111 PolarHBondContact N-O 3.44Å; Y73-G111 PolarHBondContact O-N 3.33Å
112	V	98.3	Very high	97.3	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	120.1	172.3	-173.6	0	0	0	0	107.6	Y48 S49 M63 A70 D71 L72 F123 I125	Y48-V112 CarbonylContact C-O 3.54Å; Y48-V112 VanDerWaalsContact CA-O 3.3Å; Y48-V112 WeakPolarHBondContact CA-O 3.36Å; S49-V112 PolarHBondContact N-O 2.88Å; S49-V112 PolarHBondContact O-N 2.82Å; M63-V112 HydrophobicContact SD-CG1 3.99Å; A70-V112 HydrophobicContact CB-CG1 4.01Å; D71-V112 CarbonylContact O-C 3.59Å; D71-V112 WeakPolarHBondContact O-CA 3.39Å; L72-V112 HydrophobicContact CD1-CG2 4.04Å; V112-F123 HydrophobicContact CB-CE1 4.31Å; V112-F123 HydrophobicContact CB-CZ 4.1Å; V112-F123 HydrophobicContact CG1-CD1 3.85Å; V112-F123 HydrophobicContact CG1-CD2 4.33Å; V112-F123 HydrophobicContact CG1-CE1 3.65Å; V112-F123 HydrophobicContact CG1-CE2 4.15Å; V112-F123 HydrophobicContact CG1-CG 4.19Å; V112-F123 HydrophobicContact CG1-CZ 3.81Å; V112-F123 HydrophobicContact CG2-CE2 4.13Å; V112-F123 HydrophobicContact CG2-CZ 4.09Å; V112-I125 HydrophobicContact CG2-CD1 3.74Å
113	Y	98	Very high	97.4	Very high	32 Å²	32	52.6 Å²	52.6	13%	0.125	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	134.4	-175.6	178	-115.7	0	0	0	111	G46 N47 Y48 A70 D71 Y73 P116	G46-Y113 VanDerWaalsContact C-CE2 3.45Å; N47-Y113 WeakPolarHBondContact O-CA 3.43Å; N47-Y113 WeakPolarHBondContact O-CD2 3.06Å; Y48-Y113 HydrophobicContact CD1-CD2 4.21Å; Y48-Y113 AromaticContact CD2-CD2 3.8Å; Y48-Y113 HydrophobicContact CD2-CD2 3.8Å; Y48-Y113 HydrophobicContact CD2-CE2 4.34Å; Y48-Y113 AromaticContact CE1-CD2 3.78Å; Y48-Y113 HydrophobicContact CE1-CD2 3.78Å; Y48-Y113 AromaticContact CE1-CG 3.98Å; Y48-Y113 HydrophobicContact CE1-CG 3.98Å; Y48-Y113 AromaticContact CE2-CD2 3.3Å; Y48-Y113 HydrophobicContact CE2-CD2 3.3Å; Y48-Y113 AromaticContact CE2-CE2 3.7Å; Y48-Y113 HydrophobicContact CE2-CE2 3.7Å; Y48-Y113 HydrophobicContact CE2-CG 4.26Å; Y48-Y113 HydrophobicContact CG-CD2 4.22Å; Y48-Y113 AromaticContact CZ-CD2 3.27Å; Y48-Y113 AromaticContact CZ-CE2 3.96Å; Y48-Y113 AromaticContact CZ-CG 3.77Å; A70-Y113 CarbonylContact C-O 3.52Å; A70-Y113 VanDerWaalsContact CA-O 3.28Å; A70-Y113 WeakPolarHBondContact CA-O 3.25Å; D71-Y113 HydrophobicContact CB-CD1 4.36Å; D71-Y113 PolarHBondContact N-O 2.94Å; D71-Y113 PolarHBondContact O-N 2.98Å; Y73-Y113 HydrophobicContact CE2-CG 4.43Å; Y113-P116 VanDerWaalsContact OH-CG 3.32Å; Y113-P116 WeakPolarHBondContact OH-CG 3.4Å
114	G	97.8	Very high	97.5	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.9	171	0	0	0	0	0	111.5	G46 N47	G46-G114 PolarHBondContact N-O 3.01Å; N47-G114 PolarHBondContact O-N 3.14Å
115	H	95.9	Very high	97.5	Very high	65 Å²	65	47.1 Å²	47.1	30%	0.301	23%	0.233	S	C	.	.			trans	-62.2	133.6	-179.6	-169.6	-91.2	0	0	0	111.5	D69 D71 S117 Y118	D69-H115 HydrophobicContact CB-CB 3.89Å; D69-H115 WeakPolarHBondContact O-CB 3.4Å; D69-H115 PolarHBondContact O-N 2.75Å; D71-H115 IonicContact OD2-CD2 2.7Å; H115-S117 PolarHBondContact CE1-OG 3.12Å; H115-S117 WeakPolarHBondContact ND1-CB 3.33Å; H115-S117 PolarHBondContact ND1-N 3.26Å; H115-S117 PolarHBondContact ND1-OG 3.12Å; H115-S117 PolarHBondContact O-N 3.22Å; H115-Y118 HydrophobicContact CB-CD2 4.46Å; H115-Y118 PolarHBondContact O-N 3.29Å; H115-Y118 VanDerWaalsContact O-N 3.1Å
116	P	96.9	Very high	97.6	Very high	77 Å²	77	41.2 Å²	41.2	50%	0.5	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-18	-173.1	-26.7	35.5	0	0	0	116.3	Y113 Y118	Y113-P116 VanDerWaalsContact OH-CG 3.32Å; Y113-P116 WeakPolarHBondContact OH-CG 3.4Å; P116-Y118 PolarHBondContact O-N 2.85Å
117	S	95.9	Very high	97.6	Very high	92 Å²	92	40 Å²	40	64%	0.643	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-15.8	176.8	-60	0	0	0	0	113.6	H115	H115-S117 PolarHBondContact CE1-OG 3.12Å; H115-S117 WeakPolarHBondContact ND1-CB 3.33Å; H115-S117 PolarHBondContact ND1-N 3.26Å; H115-S117 PolarHBondContact ND1-OG 3.12Å; H115-S117 PolarHBondContact O-N 3.22Å
118	Y	96.4	Very high	97.6	Very high	104 Å²	104	37.9 Å²	37.9	41%	0.408	19%	0.188	S	C	.	.	S	Bend	trans	-119	130.1	178.8	-58.6	-85.9	0	0	0	108.8	A45 D69 H115 P116 E120	A45-Y118 WeakPolarHBondContact CB-O 3.39Å; D69-Y118 HydrophobicContact CB-CD2 3.52Å; D69-Y118 HydrophobicContact CB-CE2 3.37Å; H115-Y118 HydrophobicContact CB-CD2 4.46Å; H115-Y118 PolarHBondContact O-N 3.29Å; H115-Y118 VanDerWaalsContact O-N 3.1Å; P116-Y118 PolarHBondContact O-N 2.85Å; Y118-E120 PolarHBondContact O-N 2.85Å
119	Q	97.9	Very high	97.5	Very high	182 Å²	182	40.9 Å²	40.9	85%	0.85	20%	0.2	S	C	*	.	S	Bend	trans	-59.4	-34.8	-179.8	-175.6	175.3	-2.5	0	0	111.9	A45	A45-Q119 PolarHBondContact N-O 2.75Å
120	E	97.8	Very high	97.3	Very high	83 Å²	83	41 Å²	41	39%	0.388	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	140.9	178.4	-178.1	-177.4	-104.6	0	0	108.9	I43 K67 Y118	I43-E120 CarbonylContact O-C 3.57Å; I43-E120 WeakPolarHBondContact O-CA 3.28Å; K67-E120 IonicContact NZ-OE2 3.35Å; K67-E120 PolarHBondContact NZ-OE2 2.84Å; Y118-E120 PolarHBondContact O-N 2.85Å
121	S	97.4	Very high	97	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	139.7	172.9	-54.9	0	0	0	0	109.9	H42 I43 K67 D69	H42-S121 CarbonylContact C-O 3.55Å; H42-S121 WeakPolarHBondContact CA-O 3.34Å; I43-S121 PolarHBondContact N-O 2.83Å; I43-S121 PolarHBondContact O-N 2.99Å; K67-S121 CarbonylContact O-C 3.46Å; K67-S121 WeakPolarHBondContact O-CA 3.41Å; D69-S121 VanDerWaalsContact C-OG 3.25Å; D69-S121 PolarHBondContact N-OG 2.82Å; D69-S121 PolarHBondContact O-OG 3.35Å
122	E	97.7	Very high	96.4	Very high	50 Å²	50	49.4 Å²	49.4	23%	0.234	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	134.5	175.3	-48.8	-171.9	-154.2	0	0	107.5	G41 H42 S65 L66 K67	G41-E122 WeakPolarHBondContact O-CA 3.3Å; H42-E122 WeakPolarHBondContact CD2-CG 3.28Å; H42-E122 IonicContact CD2-OE1 3.57Å; H42-E122 IonicContact CD2-OE2 3.04Å; H42-E122 IonicContact CE1-OE2 3.92Å; H42-E122 WeakPolarHBondContact NE2-CG 3.48Å; H42-E122 IonicContact NE2-OE1 3.27Å; H42-E122 IonicContact NE2-OE2 2.92Å; H42-E122 PolarHBondContact NE2-OE2 2.96Å; S65-E122 CarbonylContact C-O 3.52Å; L66-E122 HydrophobicContact CB-CB 4.27Å; L66-E122 PolarHBondContact N-O 3.15Å; K67-E122 HydrophobicContact CB-CB 4.08Å; K67-E122 HydrophobicContact CB-CG 3.97Å; K67-E122 HydrophobicContact CD-CG 3.94Å; K67-E122 WeakPolarHBondContact CD-OE1 3.3Å; K67-E122 PolarHBondContact N-O 2.78Å; K67-E122 IonicContact NZ-OE1 3.94Å; K67-E122 PolarHBondContact NZ-OE1 3.44Å; K67-E122 PolarHBondContact O-N 2.9Å
123	F	96.4	Very high	95.4	Very high	7 Å²	7	52.3 Å²	52.3	3%	0.031	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	157.5	-173.3	66.3	-92.6	0	0	0	112.5	Q40 G41 I43 M63 Q64 A70 V112 I125	Q40-F123 WeakPolarHBondContact CA-O 3.41Å; G41-F123 PolarHBondContact N-O 2.83Å; G41-F123 WeakPolarHBondContact O-CD1 3.33Å; G41-F123 PolarHBondContact O-N 2.77Å; I43-F123 HydrophobicContact CB-CE1 4.4Å; I43-F123 HydrophobicContact CG2-CD1 4.31Å; I43-F123 HydrophobicContact CG2-CE1 4.22Å; M63-F123 HydrophobicContact CG-CB 4.34Å; M63-F123 HydrophobicContact SD-CB 4.38Å; M63-F123 HydrophobicContact SD-CD2 4.3Å; M63-F123 HydrophobicContact SD-CG 4.44Å; Q64-F123 CarbonylContact O-C 3.58Å; Q64-F123 VanDerWaalsContact O-CA 3.28Å; Q64-F123 WeakPolarHBondContact O-CA 3.47Å; A70-F123 HydrophobicContact CB-CB 3.99Å; A70-F123 HydrophobicContact CB-CD1 4.12Å; A70-F123 HydrophobicContact CB-CG 4.3Å; V112-F123 HydrophobicContact CB-CE1 4.31Å; V112-F123 HydrophobicContact CB-CZ 4.1Å; V112-F123 HydrophobicContact CG1-CD1 3.85Å; V112-F123 HydrophobicContact CG1-CD2 4.33Å; V112-F123 HydrophobicContact CG1-CE1 3.65Å; V112-F123 HydrophobicContact CG1-CE2 4.15Å; V112-F123 HydrophobicContact CG1-CG 4.19Å; V112-F123 HydrophobicContact CG1-CZ 3.81Å; V112-F123 HydrophobicContact CG2-CE2 4.13Å; V112-F123 HydrophobicContact CG2-CZ 4.09Å; F123-I125 HydrophobicContact CD2-CD1 4.09Å; F123-I125 HydrophobicContact CD2-CG1 3.92Å; F123-I125 HydrophobicContact CE2-CD1 3.82Å; F123-I125 HydrophobicContact CE2-CG1 4.11Å
124	E	97.4	Very high	93.9	Very high	36 Å²	36	56.1 Å²	56.1	17%	0.168	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	131	167.9	-178.7	178.6	105.5	0	0	109.5	V38 V39 Q40 M63 Q64 L66 R126	V38-E124 HydrophobicContact CG1-CG 3.59Å; V39-E124 CarbonylContact O-C 3.49Å; V39-E124 WeakPolarHBondContact O-CA 3.39Å; Q40-E124 HydrophobicContact CG-CB 4.05Å; Q40-E124 HydrophobicContact CG-CG 3.91Å; Q40-E124 PolarHBondContact NE2-OE2 2.85Å; M63-E124 CarbonylContact C-O 3.55Å; M63-E124 VanDerWaalsContact CA-O 3.25Å; M63-E124 WeakPolarHBondContact CA-O 3.34Å; Q64-E124 PolarHBondContact N-O 2.74Å; Q64-E124 PolarHBondContact O-N 2.86Å; L66-E124 HydrophobicContact CD1-CB 4.37Å; E124-R126 HydrophobicContact CG-CG 4.4Å; E124-R126 IonicContact OE1-NE 2.69Å; E124-R126 PolarHBondContact OE1-NE 2.91Å
125	I	97.6	Very high	92.3	Very high	2 Å²	2	60.6 Å²	60.6	1%	0.01	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	117.9	171.1	-59.7	169.8	0	0	0	108.2	V38 V39 L51 L61 M63 L72 V112 F123 V127	V38-I125 CarbonylContact C-O 3.57Å; V38-I125 WeakPolarHBondContact CA-O 3.43Å; V39-I125 HydrophobicContact CB-CB 4.48Å; V39-I125 PolarHBondContact N-O 3.39Å; V39-I125 PolarHBondContact O-N 2.94Å; L51-I125 HydrophobicContact CD1-CD1 3.91Å; L61-I125 HydrophobicContact CB-CG2 4.48Å; L61-I125 HydrophobicContact CD2-CG2 4.42Å; M63-I125 HydrophobicContact CB-CG1 3.89Å; M63-I125 HydrophobicContact CG-CD1 4.47Å; M63-I125 HydrophobicContact CG-CG1 3.63Å; M63-I125 HydrophobicContact SD-CD1 4.18Å; M63-I125 HydrophobicContact SD-CG1 3.97Å; L72-I125 HydrophobicContact CD1-CD1 4.29Å; V112-I125 HydrophobicContact CG2-CD1 3.74Å; F123-I125 HydrophobicContact CD2-CD1 4.09Å; F123-I125 HydrophobicContact CD2-CG1 3.92Å; F123-I125 HydrophobicContact CE2-CD1 3.82Å; F123-I125 HydrophobicContact CE2-CG1 4.11Å; I125-V127 HydrophobicContact CG2-CG2 4Å
126	R	97.6	Very high	90.7	Very high	35 Å²	35	61.5 Å²	61.5	13%	0.132	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	122.3	166.9	-64.4	-174.2	-97.2	166.7	-6.4	108.6	D27 L35 V38 H62 E124 F128	D27-R126 IonicContact OD2-CZ 3.9Å; D27-R126 IonicContact OD2-NH1 3.89Å; D27-R126 PolarHBondContact OD2-NH1 3.13Å; D27-R126 IonicContact OD2-NH2 2.76Å; D27-R126 PolarHBondContact OD2-NH2 2.74Å; L35-R126 HydrophobicContact CD1-CB 3.92Å; L35-R126 HydrophobicContact CD1-CG 4.43Å; V38-R126 HydrophobicContact CG1-CG 4.32Å; V38-R126 HydrophobicContact CG2-CG 4.23Å; H62-R126 HydrophobicContact CB-CB 4.49Å; H62-R126 PolarHBondContact N-O 2.6Å; H62-R126 PolarHBondContact O-N 2.74Å; E124-R126 HydrophobicContact CG-CG 4.4Å; E124-R126 IonicContact OE1-NE 2.69Å; E124-R126 PolarHBondContact OE1-NE 2.91Å; R126-F128 HydrophobicContact CB-CD2 4.28Å; R126-F128 HydrophobicContact CB-CE2 3.42Å; R126-F128 VanDerWaalsContact CB-CE2 3.42Å; R126-F128 HydrophobicContact CB-CZ 3.78Å
127	V	98	Very high	89	Confident	13 Å²	13	63.1 Å²	63.1	8%	0.079	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	115.5	-177.7	-176.1	0	0	0	0	108.5	L36 H37 L53 I59 I60 L61 I125	L36-V127 WeakPolarHBondContact CB-O 3.33Å; L36-V127 PolarHBondContact N-O 3.27Å; H37-V127 HydrophobicContact CB-CB 4.21Å; H37-V127 HydrophobicContact CB-CG2 4.34Å; H37-V127 PolarHBondContact N-O 3.45Å; H37-V127 PolarHBondContact O-N 3Å; L53-V127 HydrophobicContact CD1-CG1 4.37Å; I59-V127 HydrophobicContact CG2-CG1 3.57Å; I60-V127 WeakPolarHBondContact O-CA 3.43Å; L61-V127 HydrophobicContact CD2-CG1 4.13Å; L61-V127 HydrophobicContact CD2-CG2 3.96Å; I125-V127 HydrophobicContact CG2-CG2 4Å
128	F	97.6	Very high	87.3	Confident	10 Å²	10	67 Å²	67	4%	0.044	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	147.9	-179.4	-57.8	-93.2	0	0	0	112	I29 W33 V34 L35 I59 I60 H62 R126	I29-F128 HydrophobicContact CD1-CE2 4.3Å; I29-F128 HydrophobicContact CD1-CZ 4.2Å; I29-F128 HydrophobicContact CG1-CZ 4.38Å; I29-F128 HydrophobicContact CG2-CD1 4.4Å; I29-F128 HydrophobicContact CG2-CE1 3.9Å; I29-F128 HydrophobicContact CG2-CZ 4.12Å; W33-F128 HydrophobicContact CB-CB 3.95Å; W33-F128 HydrophobicContact CB-CD1 3.94Å; W33-F128 HydrophobicContact CB-CG 4.15Å; W33-F128 HydrophobicContact CD2-CB 4.48Å; W33-F128 HydrophobicContact CE3-CB 4.35Å; W33-F128 HydrophobicContact CE3-CD2 4.16Å; W33-F128 HydrophobicContact CE3-CG 4.17Å; W33-F128 HydrophobicContact CG-CB 4.32Å; V34-F128 CarbonylContact O-C 3.57Å; V34-F128 VanDerWaalsContact O-CA 3.28Å; V34-F128 WeakPolarHBondContact O-CA 3.42Å; L35-F128 HydrophobicContact CB-CD1 3.91Å; L35-F128 HydrophobicContact CB-CE1 3.78Å; L35-F128 HydrophobicContact CD1-CD1 4.08Å; L35-F128 HydrophobicContact CD1-CE1 3.74Å; L35-F128 HydrophobicContact CD1-CE2 4.39Å; L35-F128 HydrophobicContact CD1-CZ 3.92Å; L35-F128 HydrophobicContact CG-CE1 4.32Å; I59-F128 CarbonylContact C-O 3.54Å; I59-F128 VanDerWaalsContact CA-O 3.3Å; I59-F128 WeakPolarHBondContact CA-O 3.37Å; I59-F128 WeakPolarHBondContact CG2-O 2.89Å; I60-F128 HydrophobicContact CB-CB 4.23Å; I60-F128 HydrophobicContact CD1-CB 4.39Å; I60-F128 PolarHBondContact N-O 2.69Å; I60-F128 PolarHBondContact O-N 3.33Å; H62-F128 HydrophobicContact CB-CD2 4.2Å; H62-F128 HydrophobicContact CB-CE2 3.81Å; R126-F128 HydrophobicContact CB-CD2 4.28Å; R126-F128 HydrophobicContact CB-CE2 3.42Å; R126-F128 VanDerWaalsContact CB-CE2 3.42Å; R126-F128 HydrophobicContact CB-CZ 3.78Å
129	Y	96.4	Very high	85.4	Confident	63 Å²	63	69 Å²	69	25%	0.247	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	129.9	165.6	179	-97.2	0	0	0	109.7	W33 V34 I59 Q131	W33-Y129 WeakPolarHBondContact CA-O 3.32Å; V34-Y129 PolarHBondContact N-O 3.45Å; V34-Y129 PolarHBondContact O-N 3.22Å; I59-Y129 HydrophobicContact CD1-CD2 3.8Å; Y129-Q131 HydrophobicContact CD1-CG 3.74Å; Y129-Q131 HydrophobicContact CE1-CG 3.89Å
130	D	95.4	Very high	83.2	Confident	3 Å²	3	69.9 Å²	69.9	2%	0.016	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	112	175.6	-164.2	-17.5	0	0	0	111.6	R58 I60 A132	R58-D130 HydrophobicContact CB-CB 4.13Å; R58-D130 HydrophobicContact CG-CB 4.15Å; R58-D130 IonicContact CZ-OD2 3.48Å; R58-D130 IonicContact NE-OD2 2.87Å; R58-D130 IonicContact NH1-OD2 3.94Å; R58-D130 PolarHBondContact NH1-OD2 2.82Å; R58-D130 PolarHBondContact O-N 2.96Å; I60-D130 HydrophobicContact CD1-CB 3.63Å; D130-A132 WeakPolarHBondContact OD1-CB 3.46Å; D130-A132 PolarHBondContact OD1-N 3.11Å
131	Q	92.1	Very high	80.8	Confident	121 Å²	121	69.2 Å²	69.2	57%	0.565	37%	0.37	S	S	*	.	S	Bend	trans	-81.6	-17.2	176.5	-62.3	-167.9	-16.5	0	0	113.8	E32 V34 Y129 V133	E32-Q131 WeakPolarHBondContact O-CB 3.35Å; E32-Q131 PolarHBondContact O-N 2.78Å; V34-Q131 HydrophobicContact CG2-CG 4Å; Y129-Q131 HydrophobicContact CD1-CG 3.74Å; Y129-Q131 HydrophobicContact CE1-CG 3.89Å; Q131-V133 VanDerWaalsContact C-N 3.26Å; Q131-V133 PolarHBondContact O-N 3.05Å
132	A	85.8	Confident	78.3	Confident	62 Å²	62	73.9 Å²	73.9	51%	0.512	40%	0.403	S	S	.	.	S	Bend	trans	-74	-16.5	-173.9	0	0	0	0	0	113.4	E32 D130 P134	E32-A132 HydrophobicContact CB-CB 3.93Å; E32-A132 HydrophobicContact CG-CB 3.87Å; D130-A132 WeakPolarHBondContact OD1-CB 3.46Å; D130-A132 PolarHBondContact OD1-N 3.11Å; A132-P134 VanDerWaalsContact O-CD 3.3Å; A132-P134 WeakPolarHBondContact O-CD 3.3Å
133	V	77.4	Confident	75.7	Confident	61 Å²	61	80.2 Å²	80.2	37%	0.37	44%	0.438	S	S	.	.	S	Bend	trans	-98	105.4	177.3	-176.3	0	0	0	0	109.2	Q131 Q135	Q131-V133 VanDerWaalsContact C-N 3.26Å; Q131-V133 PolarHBondContact O-N 3.05Å; V133-Q135 PolarHBondContact O-N 3.37Å
134	P	66.6	Low	73.4	Confident	113 Å²	113	83 Å²	83	73%	0.734	47%	0.469	S	S	*	.			trans	-59.1	128.9	173.9	-19.3	32.6	0	0	0	109.1	A132 D136	A132-P134 VanDerWaalsContact O-CD 3.3Å; A132-P134 WeakPolarHBondContact O-CD 3.3Å; P134-D136 PolarHBondContact O-N 2.98Å
135	Q	64.3	Low	70.7	Confident	94 Å²	94	90.8 Å²	90.8	44%	0.439	51%	0.505	S	S	.	.			trans	-65.5	115.4	166.4	-61.8	-66.5	-57.3	0	0	106.6	V133 P137	V133-Q135 PolarHBondContact O-N 3.37Å; Q135-P137 WeakPolarHBondContact O-CD 3.21Å; Q135-P137 VanDerWaalsContact O-N 3.12Å
136	D	62	Low	68	Low	84 Å²	84	97.9 Å²	97.9	45%	0.449	54%	0.544	S	S	.	.			trans	-63.4	113.5	173.7	-173.2	-20.6	0	0	0	108.1	P134 F138 E139	P134-D136 PolarHBondContact O-N 2.98Å; D136-F138 PolarHBondContact O-N 2.96Å; D136-F138 WeakPolarHBondContact OD1-CA 3.34Å; D136-F138 WeakPolarHBondContact OD1-CB 3.38Å; D136-F138 PolarHBondContact OD1-N 3.36Å; D136-E139 HydrophobicContact CB-CB 4.15Å; D136-E139 HydrophobicContact CB-CG 3.84Å; D136-E139 PolarHBondContact O-N 2.83Å
137	P	60.4	Low	65.1	Low	111 Å²	111	105.7 Å²	105.7	72%	0.721	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-14.9	-179.4	-19.2	33.5	0	0	0	113.2	Q135	Q135-P137 WeakPolarHBondContact O-CD 3.21Å; Q135-P137 VanDerWaalsContact O-N 3.12Å
138	F	61	Low	62.5	Low	172 Å²	172	114.6 Å²	114.6	75%	0.754	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105	-10.6	-174.4	-63	-83	0	0	0	114.2	D136 K140 G141	D136-F138 PolarHBondContact O-N 2.96Å; D136-F138 WeakPolarHBondContact OD1-CA 3.34Å; D136-F138 WeakPolarHBondContact OD1-CB 3.38Å; D136-F138 PolarHBondContact OD1-N 3.36Å; F138-K140 PolarHBondContact O-N 3.39Å; F138-G141 PolarHBondContact O-N 2.94Å
139	E	56.8	Low	59.4	Low	146 Å²	146	123.8 Å²	123.8	68%	0.682	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-66.6	-19.9	176.4	-87.8	-167.5	162.4	0	0	113	D136 G141	D136-E139 HydrophobicContact CB-CB 4.15Å; D136-E139 HydrophobicContact CB-CG 3.84Å; D136-E139 PolarHBondContact O-N 2.83Å; E139-G141 PolarHBondContact O-N 3.16Å
140	K	50.8	Low	56.7	Low	202 Å²	202	126 Å²	126	88%	0.878	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-72.9	7	177.8	-125.8	176.5	-173.6	173.5	0	114.8	F138	F138-K140 PolarHBondContact O-N 3.39Å
141	G	47.4	Very low	54.1	Low	69 Å²	69	131.9 Å²	131.9	71%	0.711	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-130.5	13.3	-166.9	0	0	0	0	0	117.9	F138 E139	F138-G141 PolarHBondContact O-N 2.94Å; E139-G141 PolarHBondContact O-N 3.16Å
142	S	45.5	Very low	51.9	Low	97 Å²	97	135.8 Å²	135.8	68%	0.678	74%	0.738	S	S	*	*			trans	-128	41.6	-174.2	67.5	0	0	0	0	116.3	G144	S142-G144 PolarHBondContact O-N 3.1Å
143	D	44.1	Very low	49.9	Very low	183 Å²	183	136.2 Å²	136.2	98%	0.979	75%	0.748	S	S	*	*			trans	-77.9	72.9	151.2	-85.7	-24.1	0	0	0	109.2
144	G	47	Very low	48.2	Very low	66 Å²	66	137 Å²	137	68%	0.68	76%	0.762	S	S	*	*			trans	-115	73.7	178.1	0	0	0	0	0	111.6	S142	S142-G144 PolarHBondContact O-N 3.1Å
145	Q	41.7	Very low	47.4	Very low	199 Å²	199	137.2 Å²	137.2	93%	0.93	76%	0.756	S	S	*	*			trans	-132	107.7	154.8	-76.2	-167	2.9	0	0	112
146	N	40.8	Very low	46.7	Very low	152 Å²	152	137.3 Å²	137.3	81%	0.813	76%	0.76	S	S	*	*			trans	-31.4	120.4	162.9	-82	-71.5	0	0	0	115.4
147	E	36.4	Very low	45.9	Very low	199 Å²	199	140.9 Å²	140.9	93%	0.93	77%	0.772	S	S	*	*			trans	-135.8	130	133.9	-72.7	-158.9	146.1	0	0	110.2
148	K	42.8	Very low	45.5	Very low	199 Å²	199	141.7 Å²	141.7	87%	0.865	77%	0.766	S	S	*	*			trans	-76.8	123.4	-174	-70.5	169.4	174.3	172.5	0	111.9
149	K	32.1	Very low	45.3	Very low	203 Å²	203	139.2 Å²	139.2	88%	0.883	76%	0.757	S	S	*	*			trans	-171.5	162.3	143.6	-114.5	-171.6	171.1	172.4	0	112
150	P	40.1	Very low	45.6	Very low	111 Å²	111	136.6 Å²	136.6	72%	0.721	74%	0.744	S	S	*	*			trans	-84.2	170.7	-138.2	31.1	-14.5	0	0	0	114.7
151	P	41.5	Very low	46.3	Very low	126 Å²	126	133.5 Å²	133.5	82%	0.818	73%	0.733	S	S	*	*			trans	-86.5	122.1	-164.4	33.3	-30.6	0	0	0	112.4
152	Q	46	Very low	47.7	Very low	202 Å²	202	133.8 Å²	133.8	94%	0.944	72%	0.724	S	S	*	*			trans	-143.9	117.3	157.1	-81.7	-173.4	-36.1	0	0	107.9
153	G	42.8	Very low	49.6	Very low	71 Å²	71	134 Å²	134	73%	0.732	72%	0.717	S	S	*	*			trans	144.6	49.2	178.5	0	0	0	0	0	113.8
154	A	42.8	Very low	51.7	Low	79 Å²	79	132 Å²	132	65%	0.653	70%	0.699	S	S	*	*			trans	-103.5	11.9	168.9	0	0	0	0	0	112.4
155	D	48.1	Very low	53.6	Low	116 Å²	116	136.8 Å²	136.8	62%	0.62	70%	0.697	S	S	*	*	S	Bend	trans	-88.2	-29.9	-177.2	-86.3	-21.9	0	0	0	113.6	F157 Q158 E159	D155-F157 PolarHBondContact O-N 3.03Å; D155-Q158 PolarHBondContact O-N 2.93Å; D155-E159 PolarHBondContact O-N 3.03Å
156	N	49.6	Very low	55.8	Low	97 Å²	97	132.1 Å²	132.1	52%	0.519	68%	0.682	S	S	.	*	H	α-helix	trans	-71.5	-29.9	-171.3	-158.6	72.2	0	0	0	113.6	E160	N156-E160 PolarHBondContact ND2-OE1 2.83Å; N156-E160 WeakPolarHBondContact O-CG 3.28Å; N156-E160 PolarHBondContact O-N 3.34Å
157	F	45.2	Very low	58.3	Low	158 Å²	158	129.5 Å²	129.5	69%	0.693	67%	0.667	S	S	*	*	H	α-helix	trans	-76.5	-27.6	178.6	-69.4	-81	0	0	0	113	D155 E161	D155-F157 PolarHBondContact O-N 3.03Å; F157-E161 PolarHBondContact O-N 3.21Å
158	Q	52.2	Low	61	Low	128 Å²	128	124.8 Å²	124.8	60%	0.598	65%	0.648	S	S	*	*	H	α-helix	trans	-79.4	-32.3	177.5	-73.8	-172.5	-16.2	0	0	112.4	D155 S162	D155-Q158 PolarHBondContact O-N 2.93Å; Q158-S162 PolarHBondContact O-N 2.87Å; Q158-S162 PolarHBondContact O-OG 2.8Å
159	E	58.6	Low	63.4	Low	121 Å²	121	120.1 Å²	120.1	57%	0.565	63%	0.631	S	S	*	*	H	α-helix	trans	-65.1	-42.2	174.3	-73.4	-174.1	178.1	0	0	111.5	D155 S162 I163	D155-E159 PolarHBondContact O-N 3.03Å; E159-S162 WeakPolarHBondContact O-CB 3.47Å; E159-S162 PolarHBondContact O-N 3.27Å; E159-I163 WeakPolarHBondContact O-CD1 3.4Å; E159-I163 VanDerWaalsContact O-CG1 3.3Å; E159-I163 WeakPolarHBondContact O-CG1 3.43Å; E159-I163 PolarHBondContact O-N 3.48Å; E159-I163 VanDerWaalsContact O-N 3.13Å
160	E	62.2	Low	66.3	Low	90 Å²	90	112.1 Å²	112.1	42%	0.421	61%	0.607	S	S	.	*	H	α-helix	trans	-62.1	-46.4	177.7	-69	-177.2	-154.3	0	0	111.9	N156 S162 I163 F164	N156-E160 PolarHBondContact ND2-OE1 2.83Å; N156-E160 WeakPolarHBondContact O-CG 3.28Å; N156-E160 PolarHBondContact O-N 3.34Å; E160-S162 PolarHBondContact O-N 3.09Å; E160-I163 PolarHBondContact O-N 2.82Å; E160-F164 WeakPolarHBondContact O-CD2 3.42Å; E160-F164 PolarHBondContact O-N 2.9Å
161	E	65.8	Low	68.8	Low	138 Å²	138	111.6 Å²	111.6	65%	0.645	60%	0.597	S	S	*	*	H	α-helix	trans	-58.4	-36.9	175.3	-75.2	-173.4	169.1	0	0	112.7	F157 W165	F157-E161 PolarHBondContact O-N 3.21Å; E161-W165 PolarHBondContact O-N 2.91Å
162	S	76.4	Confident	71.3	Confident	74 Å²	74	111.1 Å²	111.1	52%	0.517	59%	0.587	S	S	.	*	H	α-helix	trans	-69	-34.2	179.7	-61.7	0	0	0	0	112.6	Q158 E159 E160 T166	Q158-S162 PolarHBondContact O-N 2.87Å; Q158-S162 PolarHBondContact O-OG 2.8Å; E159-S162 WeakPolarHBondContact O-CB 3.47Å; E159-S162 PolarHBondContact O-N 3.27Å; E160-S162 PolarHBondContact O-N 3.09Å; S162-T166 PolarHBondContact O-N 3.28Å; S162-T166 PolarHBondContact O-OG1 3.38Å
163	I	85.7	Confident	73.5	Confident	102 Å²	102	108.7 Å²	108.7	52%	0.523	57%	0.573	S	S	.	*	H	α-helix	trans	-71.4	-45.4	178.2	-62.3	159.3	0	0	0	110.5	E159 E160 W165 T166 I167	E159-I163 WeakPolarHBondContact O-CD1 3.4Å; E159-I163 VanDerWaalsContact O-CG1 3.3Å; E159-I163 WeakPolarHBondContact O-CG1 3.43Å; E159-I163 PolarHBondContact O-N 3.48Å; E159-I163 VanDerWaalsContact O-N 3.13Å; E160-I163 PolarHBondContact O-N 2.82Å; I163-W165 PolarHBondContact O-N 3.29Å; I163-T166 PolarHBondContact O-N 3.4Å; I163-I167 HydrophobicContact CG2-CD1 4.01Å; I163-I167 WeakPolarHBondContact O-CG1 3.34Å; I163-I167 PolarHBondContact O-N 2.97Å; I163-I167 VanDerWaalsContact O-N 3.11Å
164	F	88.6	Confident	75.9	Confident	141 Å²	141	110 Å²	110	62%	0.618	56%	0.563	S	S	*	*	H	α-helix	trans	-60.9	-43.1	177.7	-74.8	-68.4	0	0	0	112.3	E160 T166 I167 L168	E160-F164 WeakPolarHBondContact O-CD2 3.42Å; E160-F164 PolarHBondContact O-N 2.9Å; F164-T166 VanDerWaalsContact C-N 3.34Å; F164-T166 PolarHBondContact O-N 3.14Å; F164-I167 PolarHBondContact O-N 3.38Å; F164-L168 WeakPolarHBondContact O-CB 3.46Å; F164-L168 PolarHBondContact O-N 3.5Å
165	W	86.5	Confident	78.3	Confident	167 Å²	167	110.9 Å²	110.9	63%	0.633	56%	0.555	S	S	*	*	H	α-helix	trans	-62.5	-39.1	177	-101	102.5	0	0	0	113.2	E161 I163 L168 I169	E161-W165 PolarHBondContact O-N 2.91Å; I163-W165 PolarHBondContact O-N 3.29Å; W165-L168 HydrophobicContact CE3-CD2 4.31Å; W165-L168 HydrophobicContact CZ3-CD2 4.32Å; W165-L168 PolarHBondContact O-N 3.36Å; W165-I169 HydrophobicContact CE3-CD1 3.98Å; W165-I169 HydrophobicContact CE3-CG1 4.1Å; W165-I169 HydrophobicContact CZ3-CD1 4.48Å; W165-I169 HydrophobicContact CZ3-CG1 4.42Å; W165-I169 WeakPolarHBondContact O-CG1 3.46Å; W165-I169 PolarHBondContact O-N 3.47Å
166	T	88.6	Confident	80.3	Confident	100 Å²	100	111 Å²	111	61%	0.613	56%	0.555	S	S	*	*	H	α-helix	trans	-65.6	-42.6	178.1	-57.3	0	0	0	0	111.4	S162 I163 F164 G170	S162-T166 PolarHBondContact O-N 3.28Å; S162-T166 PolarHBondContact O-OG1 3.38Å; I163-T166 PolarHBondContact O-N 3.4Å; F164-T166 VanDerWaalsContact C-N 3.34Å; F164-T166 PolarHBondContact O-N 3.14Å; T166-G170 PolarHBondContact O-N 3.03Å; T166-G170 VanDerWaalsContact O-N 3.09Å
167	I	91.6	Very high	82.2	Confident	97 Å²	97	113 Å²	113	50%	0.497	56%	0.562	S	S	.	*	H	α-helix	trans	-63.4	-43.1	175.9	-65.6	168.2	0	0	0	110.7	I163 F164 G170 L171	I163-I167 HydrophobicContact CG2-CD1 4.01Å; I163-I167 WeakPolarHBondContact O-CG1 3.34Å; I163-I167 PolarHBondContact O-N 2.97Å; I163-I167 VanDerWaalsContact O-N 3.11Å; F164-I167 PolarHBondContact O-N 3.38Å; I167-G170 PolarHBondContact O-N 3.18Å; I167-L171 HydrophobicContact CG2-CD1 4.2Å; I167-L171 PolarHBondContact O-N 3.02Å
168	L	93.8	Very high	84.3	Confident	101 Å²	101	112.1 Å²	112.1	53%	0.529	56%	0.563	S	S	.	*	H	α-helix	trans	-61	-46.5	179.7	-177.6	67.6	0	0	0	112.3	F164 W165 G170 L171 L172	F164-L168 WeakPolarHBondContact O-CB 3.46Å; F164-L168 PolarHBondContact O-N 3.5Å; W165-L168 HydrophobicContact CE3-CD2 4.31Å; W165-L168 HydrophobicContact CZ3-CD2 4.32Å; W165-L168 PolarHBondContact O-N 3.36Å; L168-G170 VanDerWaalsContact C-N 3.32Å; L168-G170 PolarHBondContact O-N 3.19Å; L168-L171 PolarHBondContact O-N 3.34Å; L168-L172 WeakPolarHBondContact O-CB 3.47Å; L168-L172 PolarHBondContact O-N 3.04Å
169	I	93.4	Very high	85.8	Confident	101 Å²	101	112.7 Å²	112.7	52%	0.518	57%	0.569	S	S	.	*	H	α-helix	trans	-64.1	-40.1	177.8	-66.4	165.6	0	0	0	110.6	W165 L172 K173	W165-I169 HydrophobicContact CE3-CD1 3.98Å; W165-I169 HydrophobicContact CE3-CG1 4.1Å; W165-I169 HydrophobicContact CZ3-CD1 4.48Å; W165-I169 HydrophobicContact CZ3-CG1 4.42Å; W165-I169 WeakPolarHBondContact O-CG1 3.46Å; W165-I169 PolarHBondContact O-N 3.47Å; I169-L172 PolarHBondContact O-N 3.21Å; I169-K173 WeakPolarHBondContact O-CB 3.45Å; I169-K173 PolarHBondContact O-N 3.23Å
170	G	91.9	Very high	86.6	Confident	35 Å²	35	118.1 Å²	118.1	36%	0.361	59%	0.591	S	S	.	*	H	α-helix	trans	-59.9	-47.7	176	0	0	0	0	0	112.6	T166 I167 L168 K173 I174	T166-G170 PolarHBondContact O-N 3.03Å; T166-G170 VanDerWaalsContact O-N 3.09Å; I167-G170 PolarHBondContact O-N 3.18Å; L168-G170 VanDerWaalsContact C-N 3.32Å; L168-G170 PolarHBondContact O-N 3.19Å; G170-K173 PolarHBondContact O-N 3.32Å; G170-I174 WeakPolarHBondContact O-CG1 3.5Å; G170-I174 PolarHBondContact O-N 3.31Å
171	L	93.5	Very high	87.8	Confident	100 Å²	100	119.5 Å²	119.5	52%	0.524	60%	0.6	S	S	.	*	H	α-helix	trans	-62.2	-44.4	176	-98.5	157.3	0	0	0	112.4	I167 L168 K173 I174 I175	I167-L171 HydrophobicContact CG2-CD1 4.2Å; I167-L171 PolarHBondContact O-N 3.02Å; L168-L171 PolarHBondContact O-N 3.34Å; L171-K173 VanDerWaalsContact C-N 3.29Å; L171-K173 PolarHBondContact O-N 3.16Å; L171-I174 PolarHBondContact O-N 3.25Å; L171-I175 WeakPolarHBondContact O-CG1 3.2Å; L171-I175 PolarHBondContact O-N 3.42Å; L171-I175 VanDerWaalsContact O-N 3.14Å
172	L	94.8	Very high	88.9	Confident	116 Å²	116	118.5 Å²	118.5	61%	0.607	60%	0.597	S	S	*	*	H	α-helix	trans	-61.3	-39.3	179	-175.3	67.9	0	0	0	111.9	L168 I169 I175 L176	L168-L172 WeakPolarHBondContact O-CB 3.47Å; L168-L172 PolarHBondContact O-N 3.04Å; I169-L172 PolarHBondContact O-N 3.21Å; L172-I175 PolarHBondContact O-N 3Å; L172-L176 PolarHBondContact O-N 2.92Å
173	K	91.8	Very high	89.6	Confident	151 Å²	151	121 Å²	121	66%	0.657	60%	0.602	S	S	*	*	H	α-helix	trans	-63.3	-43	178.2	-173.2	176.3	178.2	179	0	112.2	I169 G170 L171 I175 L176 E177	I169-K173 WeakPolarHBondContact O-CB 3.45Å; I169-K173 PolarHBondContact O-N 3.23Å; G170-K173 PolarHBondContact O-N 3.32Å; L171-K173 VanDerWaalsContact C-N 3.29Å; L171-K173 PolarHBondContact O-N 3.16Å; K173-I175 VanDerWaalsContact C-N 3.34Å; K173-I175 PolarHBondContact O-N 3.08Å; K173-L176 PolarHBondContact O-N 3.27Å; K173-E177 WeakPolarHBondContact O-CB 3.36Å; K173-E177 PolarHBondContact O-N 3.33Å
174	I	93.2	Very high	89.9	Confident	98 Å²	98	122.1 Å²	122.1	50%	0.503	61%	0.606	S	S	.	*	H	α-helix	trans	-62.1	-43.8	177.2	-66	166.8	0	0	0	110.6	G170 L171 L176 E177 I178	G170-I174 WeakPolarHBondContact O-CG1 3.5Å; G170-I174 PolarHBondContact O-N 3.31Å; L171-I174 PolarHBondContact O-N 3.25Å; I174-L176 VanDerWaalsContact C-N 3.34Å; I174-L176 PolarHBondContact O-N 3.11Å; I174-E177 PolarHBondContact O-N 3.29Å; I174-I178 HydrophobicContact CG2-CD1 3.89Å; I174-I178 VanDerWaalsContact O-CG1 3.31Å; I174-I178 WeakPolarHBondContact O-CG1 3.1Å; I174-I178 PolarHBondContact O-N 3.29Å; I174-I178 VanDerWaalsContact O-N 3.11Å
175	I	93.6	Very high	89.9	Confident	98 Å²	98	120.9 Å²	120.9	50%	0.503	61%	0.605	S	S	.	*	H	α-helix	trans	-63.2	-42.5	179.4	-65.6	167.1	0	0	0	110.8	L171 L172 K173 I178 L179	L171-I175 WeakPolarHBondContact O-CG1 3.2Å; L171-I175 PolarHBondContact O-N 3.42Å; L171-I175 VanDerWaalsContact O-N 3.14Å; L172-I175 PolarHBondContact O-N 3Å; K173-I175 VanDerWaalsContact C-N 3.34Å; K173-I175 PolarHBondContact O-N 3.08Å; I175-I178 PolarHBondContact O-N 2.84Å; I175-L179 WeakPolarHBondContact O-CB 3.31Å; I175-L179 PolarHBondContact O-N 3.37Å
176	L	90.1	Very high	90.2	Very high	117 Å²	117	117.9 Å²	117.9	61%	0.613	60%	0.604	S	S	*	*	H	α-helix	trans	-64.6	-40.5	178.4	-160.7	88.3	0	0	0	111.9	L172 K173 I174 I178 L179 F180	L172-L176 PolarHBondContact O-N 2.92Å; K173-L176 PolarHBondContact O-N 3.27Å; I174-L176 VanDerWaalsContact C-N 3.34Å; I174-L176 PolarHBondContact O-N 3.11Å; L176-I178 VanDerWaalsContact C-N 3.27Å; L176-I178 PolarHBondContact O-N 3.34Å; L176-L179 PolarHBondContact O-N 3.43Å; L176-F180 PolarHBondContact O-N 3.25Å; L176-F180 VanDerWaalsContact O-N 3.16Å
177	E	88.8	Confident	90.3	Very high	141 Å²	141	119.1 Å²	119.1	66%	0.659	60%	0.603	S	S	*	*	H	α-helix	trans	-66.3	-27	177.4	-173.5	174.5	171.7	0	0	113.1	K173 I174	K173-E177 WeakPolarHBondContact O-CB 3.36Å; K173-E177 PolarHBondContact O-N 3.33Å; I174-E177 PolarHBondContact O-N 3.29Å
178	I	89.4	Confident	90.2	Very high	139 Å²	139	120.8 Å²	120.8	71%	0.713	61%	0.611	S	S	*	*	H	α-helix	trans	-79	-30	174.2	-67.1	165.5	0	0	0	111.3	I174 I175 L176	I174-I178 HydrophobicContact CG2-CD1 3.89Å; I174-I178 VanDerWaalsContact O-CG1 3.31Å; I174-I178 WeakPolarHBondContact O-CG1 3.1Å; I174-I178 PolarHBondContact O-N 3.29Å; I174-I178 VanDerWaalsContact O-N 3.11Å; I175-I178 PolarHBondContact O-N 2.84Å; L176-I178 VanDerWaalsContact C-N 3.27Å; L176-I178 PolarHBondContact O-N 3.34Å
179	L	83.1	Confident	89.9	Confident	140 Å²	140	122.5 Å²	122.5	73%	0.733	62%	0.618	S	S	*	*	H	α-helix	trans	-88.7	-17	-172.5	-153.6	108.4	0	0	0	113.7	I175 L176	I175-L179 WeakPolarHBondContact O-CB 3.31Å; I175-L179 PolarHBondContact O-N 3.37Å; L176-L179 PolarHBondContact O-N 3.43Å
180	F	74.9	Confident	89.5	Confident	234 Å²	234	124.5 Å²	124.5	100%	1.026	63%	0.627	S	S	*	*			trans	-136.3	0	-173.9	-125.6	-80.4	0	0	0	111.7	L176	L176-F180 PolarHBondContact O-N 3.25Å; L176-F180 VanDerWaalsContact O-N 3.16Å

Retrieved 180 of 180 residues in 120.8 ms (Link to these results)

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